Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.57 |
| ▸ | PNMT | P11086 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | CTSG | P08311 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5537535 | 0.83 | TAAR1 (0.54) | TAAR1PNMTIDO1SMN1; SMN2 | |
| SCHEMBL4987170 | 0.80 | TAAR1 (0.57) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL5535148 | 0.79 | PNMT (0.56) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL10690855 | 0.77 | TAAR1 (0.63) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL97847 | 0.77 | TAAR1 (0.52) | TAAR1ALDH1A1POLBCYP1A2GLA | |
| SCHEMBL5544906 | 0.76 | TAAR1 (0.52) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL18263455 | 0.76 | TAAR1 (0.52) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL14833068 | 0.73 | TAAR1 (0.53) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL9828207 | 0.72 | TAAR1 (0.63) | TAAR1PNMTIDO1KDM4EALDH1A1 | |
| SCHEMBL2963562 | 0.72 | TAAR1 (0.63) | TAAR1PNMTIDO1KDM4EALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998009987-A1 | LACTAM INHIBITORS OF THROMBIN | BIOCHEM PHARMA, INC. (CA) | 1998-03-12 | — | — | WO | disclosed |