Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6186843 | 0.91 | ALDH1A1 (0.40) | KMT2AGAAALDH1A1KDM4EHPGD | |
| SCHEMBL6185825 | 0.88 | TYK2 (0.45) | KMT2AMEN1GAASMN1; SMN2ALDH1A1 | |
| SCHEMBL6185686 | 0.82 | DAPK3 (0.48) | KMT2AMEN1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6189327 | 0.81 | HPGD (0.46) | KMT2AMEN1GAASMN1; SMN2ALDH1A1 | |
| SCHEMBL6185706 | 0.80 | MAOB (0.42) | KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL6186285 | 0.79 | MAOA (0.49) | GAASMN1; SMN2ALDH1A1KDM4ENPSR1 | |
| SCHEMBL6185134 | 0.78 | MAOA (0.54) | SMN1; SMN2ALDH1A1KDM4ENPSR1HPGD | |
| SCHEMBL6188852 | 0.76 | RAB9A (0.55) | KMT2AMEN1SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL6190881 | 0.75 | PARP1 (0.47) | KMT2AMEN1SMN1; SMN2HTTNPSR1 | |
| SCHEMBL6185980 | 0.74 | LMNA (0.41) | KMT2AGAASMN1; SMN2ALDH1A1HTT |
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-1554271-A1 | SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS | Rigel Pharmaceuticals, Inc. (US) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004035571-A1 | SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS | RIGEL PHARMACEUTICALS, INC. (US) | 2004-04-29 | — | — | WO | disclosed |