Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.48 |
| ▸ | MAOB | P27338 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.47 |
| ▸ | AR | P10275 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7767263 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL3356400 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL23662191 | 0.84 | MAOB (0.51) | MAPTMAOBADORA3ARKDM4E | |
| SCHEMBL24496711 | 0.84 | MAOB (0.51) | MAPTMAOBADORA3ARKDM4E | |
| SCHEMBL3399029 | 0.84 | MAOB (0.51) | MAPTMAOBADORA3ARKDM4E | |
| SCHEMBL29586863 | 0.84 | MAOB (0.51) | MAPTMAOBADORA3ARKDM4E | |
| SCHEMBL22617489 | 0.84 | MAOB (0.53) | MAPTMAOBADORA3ARKDM4E | |
| SCHEMBL22617255 | 0.84 | MAOB (0.53) | MAPTMAOBADORA3ARKDM4E | |
| SCHEMBL17960189 | 0.83 | CYP19A1 (0.51) | MAOBCYP19A1 | |
| SCHEMBL3355709 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDMEN1KMT2A |
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-2001092249-A2 | CHIRAL AND ACHIRAL SYNTHESIS OF 2-ACYL SUBSTITUTED CHROMANES AND THEIR DERIVATIVES | COR THERAPEUTICS, INC. (US) | 2001-12-06 | — | — | WO | disclosed |