Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 5/20 | 0.44 |
| ▸ | MAOB | P27338 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL49620 | 0.74 | ERBB2 (1.00) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL28861798 | 0.74 | ERBB2 (0.58) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL1067701 | 0.74 | ERBB2 (0.58) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL20087538 | 0.72 | MAOA (0.57) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL28113764 | 0.70 | ERBB2 (0.91) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL899103 | 0.70 | ERBB2 (0.54) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL8582510 | 0.69 | ERBB2 (0.58) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL1524084 | 0.69 | ERBB2 (0.58) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL3155612 | 0.69 | MAOA (0.53) | ERBB2TDP1MEN1MAPTKMT2A | |
| SCHEMBL10333756 | 0.69 | ERBB2 (0.52) | ERBB2TDP1MEN1MAPTKMT2A |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109923106-A | Toll sample receptor modulator compounds | 吉利德科学公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-107709315-A | The inhibitor of bruton's tyrosine kinase | 药品循环有限责任公司 | 2018-02-16 | — | — | CN | disclosed |
| CN-107530347-A | The co-crystal thereof of bruton's tyrosine kinase inhibitor | 药品循环有限责任公司 | 2018-01-02 | — | — | CN | disclosed |
| CN-107530346-A | The solvation form of bruton's tyrosine kinase inhibitor | 药品循环有限责任公司 | 2018-01-02 | — | — | CN | disclosed |
| CN-106661039-A | TYK2 inhibitors and uses thereof | 林伯士拉克许米公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-104853754-A | Azaindole derivatives as jak3 inhibitors | PRINCIPIA BIOPHARMA INC | 2015-08-19 | — | — | CN | disclosed |
| CN-103097353-B | Immunomodulator and anti-inflammatory compound | INCOZEN THERAPEUTICS PVT LTD | 2015-03-04 | — | — | CN | disclosed |
| CN-103097353-A | Novel immunomodulator and anti-inflammatory compounds | INCOZEN THERAPEUTICS PVT LTD | 2013-05-08 | — | — | CN | disclosed |
| CN-102665711-A | Anticancer combination of artemisinin-based drugs and other chemotherapeutic agents | SIGMA TAU IND FARMACEUTI | 2012-09-12 | — | — | CN | disclosed |
| CN-101589025-B | Aminonicotinic acid and isonicotinic acid derivatives as dihydrolactate dehydrogenase (DHODH) inhibitors | ALMIRALL LAB | 2012-05-30 | — | — | CN | disclosed |
| CN-102256969-A | Compounds that modulate intracellular calcium | CALCIMEDICA INC | 2011-11-23 | — | — | CN | disclosed |
| CN-101589025-A | Aminonicotinic acid and isonicotinic acid derivatives as dihydrolactate dehydrogenase (DHODH) inhibitors | ALMIRALL LAB (ES) | 2009-11-25 | — | — | CN | disclosed |
| CN-101421269-A | Inhibitors of tyrosine kinases and uses thereof | PHARMACYCLICS INC (US) | 2009-04-29 | — | — | CN | disclosed |
| CN-1980902-A | Method for preparing 5-'4-(2-hydroxy-propyl)-3,5-dioxo-4,5-dihydro-3h'1,2,4!triazin-2-yl!-benzamide derivatives by deprotecting the hydroxyl-protected precursers | PFIZER (US) | 2007-06-13 | — | — | CN | disclosed |
| CN-1886157-A | Pharmaceutical combinations | NOVARTIS AG (CH) | 2006-12-27 | — | — | CN | disclosed |