Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 10/20 | 0.48 |
| ▸ | CYP3A5 | P20815 | 10/20 | 0.48 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2910952 | 0.86 | CYP3A4 (0.51) | CYP3A4CYP3A5KDM4EALDH1A1POLB | |
| SCHEMBL3294234 | 0.84 | CYP3A4 (0.49) | CYP3A4CYP3A5FNTAFNTBKDM4E | |
| SCHEMBL2909234 | 0.78 | SLC6A9 (0.42) | CYP3A4HTTTBXA2RUSP2 | |
| SCHEMBL4027883 | 0.76 | CYP3A4 (0.56) | CYP3A4CYP3A5FNTAFNTBKDM4E | |
| SCHEMBL2905660 | 0.75 | CYP3A4 (0.54) | CYP3A4CYP3A5FNTAFNTBCYP19A1 | |
| SCHEMBL2905664 | 0.75 | CYP3A4 (0.54) | CYP3A4CYP3A5FNTAFNTBCYP19A1 | |
| SCHEMBL2906358 | 0.75 | CYP3A4 (0.54) | CYP3A4CYP3A5FNTAFNTBCYP19A1 | |
| SCHEMBL2906185 | 0.75 | CYP3A4 (0.53) | CYP3A4CYP3A5FNTAFNTBKDM4E | |
| SCHEMBL2909216 | 0.75 | CYP3A4 (0.38) | CYP3A4CYP3A5HTTCYP19A1 | |
| SCHEMBL2911655 | 0.73 | KMT2A (0.39) | HTTCYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6355631-B1 | TREATMENT OF PSYCHOSIS AND SCHIZOPHRENIA | AVENTIS PHARMA S.A. (FR) | 2002-03-12 | — | — | US | disclosed |