Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | PON1 | P27169 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7459767 | 0.95 | KMT2A (0.33) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL9927373 | 0.86 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL9927378 | 0.83 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL8588261 | 0.83 | CYP1A2 (0.40) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL8054073 | 0.82 | CYP1A2 (0.37) | L3MBTL1CYP1A2KDM4ECYP2A6KMT2A | |
| SCHEMBL7456742 | 0.82 | CYP1A2 (0.33) | CYP1A2KDM4ECYP2A6KMT2APON1 | |
| SCHEMBL13229011 | 0.81 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL24012571 | 0.80 | ALDH1A1 (0.38) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL7462964 | 0.80 | ALDH1A1 (0.38) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL26848610 | 0.80 | ALDH1A1 (0.42) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 |
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-5807905-A | POLYMERIZATION OF UNSATURATED COMPOUNDS | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-09-15 | — | — | US | disclosed |