Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 4/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.47 |
| ▸ | CMA1 | P23946 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.46 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | EDNRB | P24530 | 1/20 | 0.42 |
| ▸ | EDNRA | P25101 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14501653 | 0.85 | SCN9A (0.55) | SCN9ACASP3OPRL1CMA1MMP12 | |
| SCHEMBL16109588 | 0.81 | SCN9A (0.56) | SCN9ACMA1MMP12ADAMTS5L3MBTL1 | |
| SCHEMBL9539012 | 0.80 | OPRL1 (0.51) | SCN9ACASP3OPRL1CMA1MMP12 | |
| SCHEMBL17377477 | 0.77 | SCN9A (0.63) | SCN9ACASP3OPRL1CMA1MMP12 | |
| SCHEMBL25430199 | 0.76 | SCN9A (0.65) | SCN9ACASP3OPRL1CMA1MMP12 | |
| SCHEMBL17416402 | 0.73 | OPRL1 (0.70) | SCN9AOPRL1CMA1MMP12ADAMTS5 | |
| SCHEMBL15973283 | 0.72 | SCN9A (0.51) | SCN9ACASP3CMA1MMP12ADAMTS5 | |
| SCHEMBL16812434 | 0.72 | OPRL1 (0.60) | SCN9ACASP3OPRL1CMA1MMP12 | |
| SCHEMBL8552517 | 0.72 | SCN9A (0.54) | SCN9ACASP3OPRL1CMA1MMP12 | |
| SCHEMBL1773322 | 0.71 | CMA1 (0.60) | CASP3CMA1L3MBTL1GSK3AGSK3B |
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-1993004047-A1 | QUINAZOLINE DERIVATIVES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO., INC. (US) | 1993-03-04 | — | — | WO | disclosed |