Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30252315 | 1.00 | CYP19A1 (0.43) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| Methyl Alcohol SCHEMBL27754530 | 0.94 | TSHR (0.42) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL7412881 | 0.88 | CYP19A1 (0.41) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL2154210 | 0.86 | SMN1; SMN2 (0.49) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL29633128 | 0.84 | CYP19A1 (0.39) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL27532550 | 0.84 | ESR2 (0.42) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL29513232 | 0.82 | CYP19A1 (0.46) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL28248935 | 0.82 | CYP19A1 (0.46) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL899 | 0.82 | CYP19A1 (0.46) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL28248440 | 0.82 | CYP19A1 (0.46) | CYP19A1SMN1; SMN2ALDH1A1MAPTTSHR |
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 115 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104193726-A | Synthesis method of alogliptin benzoate | JIANGSU DEYUAN PHARMACEUTICAL CO LTD | 2014-12-10 | — | — | CN | claimed |
| CN-104151291-A | Preparation method for benzoic acid alogliptin polycrystalline type crystal | JIANGSU DEYUAN PHARMACEUTICAL CO LTD | 2014-11-19 | — | — | CN | claimed |
| CN-115427410-B | Amide or sulfonamide derivatives and application thereof | 苏州恩华生物医药科技有限公司 | 2024-02-23 | — | — | CN | disclosed |
| CN-115427410-A | Amide or sulfonamide derivative and application thereof | 苏州恩华生物医药科技有限公司 | 2022-12-02 | — | — | CN | disclosed |
| WO-2021213353-A1 | AMIDE OR SULFONAMIDE DERIVATIVE AND USE THEREOF | 苏州恩华生物医药科技有限公司 (CN) | 2021-10-28 | — | — | WO | disclosed |
| CN-104080787-B | Pyrazolo pyrrolidine compound | 诺华股份有限公司 | 2016-09-14 | — | — | CN | disclosed |
| CN-104066732-B | Novel antiviral Pyrrolopyridine derivatives and preparation method thereof | KOREA CHEMICAL RESEARCH INSTITUTE (KR) | 2016-04-13 | — | — | CN | disclosed |
| CN-102666545-B | As the heterocycle Pyrazolopyrimidine analogs of JAK inhibitor | CELLZOME LTD. (GB) | 2016-04-06 | — | — | CN | disclosed |
| EP-2785717-B1 | PYRAZOLOPYRROLIDINE COMPOUNDS | NOVARTIS AG (CH) | 2016-01-13 | — | — | EP | disclosed |
| CN-102459258-B | Preparation and use of 1,2, 4-triazolo [1,5a ] pyridine derivatives | CEPHALON, INC. (US) | 2015-11-25 | — | — | CN | disclosed |
| CN-105051044-A | Compounds and their use for modulating hemoglobin | GLOBAL BLOOD THERAPEUTICS INC | 2015-11-11 | — | — | CN | disclosed |
| CN-1112125-A | Acyloxyhexanoic acid derivatives | CIBA GEIGY AG (CH) | 1995-11-22 | — | — | CN | disclosed |
| CN-1052672-A | Benzofuran derivative | GLAXO GROUP LTD (GB) | 1991-07-03 | — | — | CN | disclosed |
| US-5015641-A | Dipeptide for vision defects | ANDREWS DAVID R (US) | 1991-05-14 | — | — | US | disclosed |
| US-4885293-A | CARBOXYALKYL DIPEPTIDES | SCHERING CORPORATION (US) | 1989-12-05 | — | — | US | disclosed |
| EP-0195817-B1 | CARBOXYALKYLDIPEPTIDES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING CORPORATION (US) | 1989-10-18 | — | — | EP | disclosed |
| US-4826816-A | Antihypertensive compounds | SCHERING CORPORATION (US) | 1989-05-02 | — | — | US | disclosed |
| CN-1030749-A | The method for preparing Fungicidal compounds | ICI PLC (GB) | 1989-02-01 | — | — | CN | disclosed |
| US-4634698-A | TOPICAL HYPOTENSIVES | SCHERING CORPORATION (US) | 1987-01-06 | — | — | US | disclosed |
| US-4556655-A | TREATMENT OF CARDIOVASCULAR DISORDERS AND GLAUCOMA | SCHERING CORPORATION (US) | 1985-12-03 | — | — | US | disclosed |