Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.46 |
| ▸ | HTR3B | O95264 | 1/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.46 |
| ▸ | MIF | P14174 | 1/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL564229 | 0.85 | TAAR1 (0.47) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL943888 | 0.82 | IDO1 (0.50) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL2090624 | 0.80 | IDO1 (0.48) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL12121938 | 0.78 | IDO1 (0.46) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL11478072 | 0.78 | IDO1 (0.46) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL16775681 | 0.78 | IDO1 (0.46) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL13435556 | 0.78 | TAAR1 (0.41) | IDO1TAAR1LMNACYP2A6HTR3E | |
| SCHEMBL18835003 | 0.77 | AOC3 (0.41) | IDO1TAAR1HTR3EHTR3BHTR3A | |
| SCHEMBL9232607 | 0.76 | TAAR1 (0.40) | IDO1TAAR1HTR3EHTR3BHTR3A | |
| SCHEMBL2091029 | 0.74 | MAOB (0.48) | IDO1TAAR1LMNACYP2A6AGXT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105530932-B | Primary formamide as BTK inhibitor | 艾伯维公司 | 2019-09-27 | — | — | CN | disclosed |
| CN-105530932-A | Primary carboxamides as BIK inhibitors | ABBVIE INC | 2016-04-27 | — | — | CN | disclosed |