Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | GALR2 | O43603 | 1/20 | 0.52 |
| ▸ | MITF | O75030 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | XBP1 | P17861 | 1/20 | 0.52 |
| ▸ | CCR6 | P51684 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL16529634 | 0.85 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRNPC1SMN1; SMN2 | |
| SCHEMBL6422578 | 0.84 | KMT2A (0.65) | ALDH1A1NPC1SMN1; SMN2LMNAPOLB | |
| SCHEMBL6750268 | 0.84 | SMN1; SMN2 (0.65) | ALDH1A1NPC1SMN1; SMN2LMNAPOLB | |
| SCHEMBL2126420 | 0.84 | CA12 (0.62) | ALDH1A1TSHRNPC1SMN1; SMN2LMNA | |
| SCHEMBL616603 | 0.83 | GAA (0.63) | ALDH1A1CYP3A4TSHRRECQLSMN1; SMN2 | |
| SCHEMBL31391703 | 0.82 | MAPT (0.55) | ALDH1A1TSHRNPC1SMN1; SMN2LMNA | |
| SCHEMBL28999592 | 0.82 | SMN1; SMN2 (0.53) | ALDH1A1TSHRNPC1SMN1; SMN2LMNA | |
| SCHEMBL6350616 | 0.82 | ALDH1A1 (0.52) | ALDH1A1TSHRNPC1SMN1; SMN2LMNA | |
| SCHEMBL3092769 | 0.82 | MAPT (0.55) | ALDH1A1TSHRNPC1SMN1; SMN2LMNA | |
| SCHEMBL29091595 | 0.81 | MAPT (0.55) | ALDH1A1NPC1SMN1; SMN2LMNAPOLB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0661259-B1 | Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity | BRISTOL MYERS SQUIBB CO (US) | 1997-10-08 | — | — | EP | disclosed |
| US-5648385-A | TREATING RHEUMATOID ARTHRITIS | BRISTOL-MYERS SQUIBB CO. (US) | 1997-07-15 | — | — | US | disclosed |
| US-5618839-A | Retinoid-like compounds | BRISTOL-MYERS SQUIBB COMPANY (US) | 1997-04-08 | — | — | US | disclosed |
| EP-0661259-A1 | Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-07-05 | — | — | EP | disclosed |