Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | F12 | P00748 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | S100A4 | P26447 | 1/20 | 0.49 |
| ▸ | NQO2 | P16083 | 1/20 | 0.49 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27667635 | 0.98 | PLAU (0.48) | PLAUCYP2A6F12NCF1NOS3 | |
| Hydrochloric Acid SCHEMBL27892483 | 0.98 | PLAU (0.48) | PLAUCYP2A6F12NCF1NOS3 | |
| Formaldehyde SCHEMBL22343884 | 0.96 | PLAU (0.47) | PLAUCYP2A6F12NCF1NOS3 | |
| Boric Acid SCHEMBL27989300 | 0.93 | NCOA3 (0.47) | PLAUCYP2A6F12NCF1NOS3 | |
| Furan SCHEMBL28122491 | 0.91 | S100A4 (0.43) | PLAUCYP2A6F12NCF1NOS3 | |
| Quinoline SCHEMBL28086932 | 0.88 | ALDH1A1 (0.55) | PLAUCYP2A6F12NCF1NOS3 | |
| Quinazoline SCHEMBL28491213 | 0.83 | EGFR (0.57) | PLAUCYP2A6F12NCF1NOS3 | |
| Quinoline SCHEMBL28123047 | 0.82 | ALDH1A1 (0.47) | PLAUCYP2A6F12NCF1NOS3 | |
| SCHEMBL25376432 | 0.81 | S100A4 (0.39) | PLAUCYP2A6F12NCF1NOS3 | |
| SCHEMBL895053 | 0.79 | PLAU (0.50) | PLAUCYP2A6F12NCF1NOS3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1048 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117586170-A | Indolinyl acyl derivative and synthetic method of isoquinoline formyl derivative | 江苏集萃分子工程研究院有限公司 | 2024-02-23 | — | — | CN | claimed |
| CN-117209395-A | Synthesis method and anticancer activity of selective targeted proliferation cell nuclear antigen drug | 苏州祥沁医疗科技有限公司 | 2023-12-12 | — | — | CN | claimed |
| CN-113980039-B | Photothermal agent and preparation method and application thereof | 杭州师范大学 | 2023-08-18 | — | — | CN | claimed |
| CN-115433203-A | Amine fluorinated curcumenol derivative compound and application and preparation method thereof | 华东理工大学 | 2022-12-06 | — | — | CN | claimed |
| CN-114773334-A | Indolo [2, 1-alpha ] isoquinoline compound and preparation method and application thereof | 杭州医学院 | 2022-07-22 | — | — | CN | claimed |
| CN-110066246-B | Method for preparing isoquinoline-1-ketone derivative | 哈尔滨工业大学 | 2022-04-22 | — | — | CN | claimed |
| CN-110066246-A | A method of preparing isoquinoline-1-ketone derivative | 哈尔滨工业大学 | 2019-07-30 | — | — | CN | claimed |
| CN-104903314-B | 1- [1- (benzoyl)-pyrrolidines -2- carbonyls]-pyrrolidines -2- 6-carbonitrile derivatives | 巴塞罗纳大学 | 2018-06-05 | — | — | CN | claimed |
| CN-107613981-A | Bu Luomo domain inhibitor | 赛尔基因昆蒂赛尔研究公司 | 2018-01-19 | — | — | CN | claimed |
| CN-103958478-B | Bicyclic dihydroisoquinolin-1-one derivatives | 霍夫曼-拉罗奇有限公司 | 2017-08-01 | — | — | CN | claimed |
| US-5510487-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS INFECTIONS | G.D. SEARLE & CO. (US) | 1996-04-23 | — | — | US | claimed |
| US-5482947-A | ENZYME INHIBITORS FOR HIV PROTEASE INHIBITION FROM UREA OR THIOUREA COMPOUNDS | TALLEY JOHN J (US) | 1996-01-09 | — | — | US | claimed |
| US-5430041-A | Amino acid derivatives having antiviral activity | HOFFMANN-LA ROCHE INC. (US) | 1995-07-04 | — | — | US | claimed |
| CN-1089606-A | Antiretroviral acyl compounds | CIBA GEIGY AG (CH) | 1994-07-20 | — | — | CN | claimed |
| US-5322842-A | Tricyclic benzodiazepine derivates, their preparation, and pharmaceutical compositions containing them | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-21 | — | — | US | claimed |
| EP-0544909-A1 | TRICYCLIC BENZODIAZEPINE DERIVATES THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1993-06-09 | — | — | EP | claimed |
| EP-0520336-A2 | Aldehyde derivatives and their use as calpain inhibitors | FUJIREBIO Inc. (JP) | 1992-12-30 | — | — | EP | claimed |
| WO-1992003438-A1 | TRICYCLIC BENZODIAZEPINE DERIVATES THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-03-05 | — | — | WO | claimed |
| US-5021421-A | Psychotropic agents | DAINIPPON PHARMACEUTICAL CO., LTD. (JP) | 1991-06-04 | — | — | US | claimed |
| US-4727060-A | HYPOTENSIVE AGENTS | CIBA-GEIGY CORPORATION (US) | 1988-02-23 | — | — | US | claimed |