Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 6/20 | 0.46 |
| ▸ | THRA | P10827 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | TACR2 | P21452 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SHBG | P04278 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSPD1 | P10809 | 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 | |
|---|---|---|---|---|
| SCHEMBL8401292 | 1.00 | CYP3A4 (0.55) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL7599363 | 1.00 | CYP3A4 (0.55) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL8401291 | 1.00 | CYP3A4 (0.55) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL10764013 | 0.92 | CYP3A4 (0.62) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL3623036 | 0.92 | CYP3A4 (0.62) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL12416633 | 0.92 | CYP3A4 (0.62) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL10346503 | 0.89 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL12416611 | 0.89 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL1878786 | 0.88 | CYP3A4 (0.57) | CYP3A4CYP2D6CYP2C9THRBTHRA | |
| SCHEMBL3620867 | 0.86 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9THRBTHRA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0849289-B1 | HYDROLYZABLE RESIN CONTAINING ALDEHYDE BONDED THERETO AND SELF-POLISHING ANTIFOULING PAINT | NIPPON PAINT CO LTD (JP) | 2002-11-27 | — | — | EP | disclosed |
| US-5914357-A | VINYL POLYMER HAVING PRIMARY AMINO GROUPS IN THE FORM OF SCHIFF BASE | NIPPON PAINT CO., LTD. (JP) | 1999-06-22 | — | — | US | disclosed |
| EP-0849289-A1 | HYDROLYZABLE RESIN CONTAINING ALDEHYDE BONDED THERETO AND SELF-POLISHING ANTIFOULING PAINT | NIPPON PAINT CO., LTD. (JP) | 1998-06-24 | — | — | EP | disclosed |