Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | IDH2 | P48735 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 3/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8329053 | 0.87 | ALDH1A1 (0.56) | TSHRALDH1A1KIF11TACR1TAAR1 | |
| SCHEMBL4249887 | 0.82 | TAAR1 (0.46) | TSHRALDH1A1MAPK1TAAR1MEN1 | |
| SCHEMBL8324574 | 0.80 | KIF11 (0.46) | TSHRKIF11TAAR1CYP3A4CYP2D6 | |
| SCHEMBL8322592 | 0.79 | TSHR (0.46) | TSHRKIF11MAPK1TAAR1MEN1 | |
| SCHEMBL8328588 | 0.79 | KIF11 (0.45) | TSHRALDH1A1KIF11TAAR1SIGMAR1 | |
| SCHEMBL8322927 | 0.76 | KIF11 (0.49) | TSHRALDH1A1KIF11TACR1MAPK1 | |
| SCHEMBL8326388 | 0.76 | KIF11 (0.50) | ALDH1A1KIF11TACR1TAAR1MAPT | |
| Benzene SCHEMBL8568955 | 0.76 | TSHR (0.67) | TSHRALDH1A1KIF11MAPK1HTR2A | |
| SCHEMBL8325626 | 0.76 | KCNN4 (0.43) | TSHRALDH1A1KIF11MAPK1TAAR1 | |
| SCHEMBL8327484 | 0.73 | KIF11 (0.40) | TSHRKIF11HTTRAB9ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0948496-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE | Amgen inc. (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998024780-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE | AMGEN INC. (US) | 1998-06-11 | — | — | WO | disclosed |