Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.44 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200109 | 0.82 | NAPRT (0.62) | NAPRTCYP1A2CYP3A4CYP2C9RECQL | |
| Water SCHEMBL27728999 | 0.79 | NAPRT (0.96) | NAPRTCYP1A2CYP3A4CYP2C9RECQL | |
| SCHEMBL3253168 | 0.79 | NAPRT (0.74) | NAPRTCYP1A2CYP3A4CYP2C9RECQL | |
| SCHEMBL20332456 | 0.79 | NAPRT (0.53) | NAPRTCYP1A2CYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL15515595 | 0.77 | NAPRT (0.71) | NAPRTCYP1A2CYP3A4CYP2C9RECQL | |
| SCHEMBL48609 | 0.77 | NAPRT (1.00) | NAPRTCYP1A2CYP3A4CYP2C9RECQL | |
| SCHEMBL3225657 | 0.77 | CYP19A1 (0.44) | ALDH1A1KDM4EGAACYP19A1 | |
| SCHEMBL29430342 | 0.77 | NAPRT (1.00) | NAPRTCYP1A2CYP3A4CYP2C9RECQL | |
| SCHEMBL955096 | 0.77 | CES1 (0.56) | CYP3A4CYP2C9ALDH1A1HTTLMNA | |
| SCHEMBL8603768 | 0.76 | NAPRT (0.69) | NAPRTCYP1A2CYP3A4CYP2C9RECQL |
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-1926719-A2 | 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-06-04 | — | — | EP | disclosed |
| WO-2007031440-A2 | 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-03-22 | — | — | WO | disclosed |