Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.59 |
| ▸ | NPC1 | O15118 | 5/20 | 0.59 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.59 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 4/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | CA7 | P43166 | 2/20 | 0.55 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | ANPEP | P15144 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL27496473 | 0.88 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2NPC1RAB9AHSP90AA1 | |
| SCHEMBL9376852 | 0.85 | ANPEP (0.61) | ALDH1A1SMN1; SMN2NPC1RAB9AHSP90AA1 | |
| SCHEMBL1355962 | 0.80 | CA1 (0.67) | ALDH1A1SMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL9787288 | 0.80 | KMT2A (0.56) | ALDH1A1SMN1; SMN2NPC1RAB9AHSP90AA1 | |
| SCHEMBL10418379 | 0.79 | PTPN1 (0.61) | ALDH1A1SMN1; SMN2NPC1RAB9AHSP90AA1 | |
| SCHEMBL9787043 | 0.77 | CA1 (0.64) | ALDH1A1SMN1; SMN2NPC1RAB9APTPN1 | |
| SCHEMBL5899479 | 0.77 | PTPN1 (0.67) | ALDH1A1SMN1; SMN2NPC1RAB9APTPN1 | |
| SCHEMBL14398426 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2NPC1RAB9AHSP90AA1 | |
| SCHEMBL1974978 | 0.76 | PTPN1 (0.71) | ALDH1A1SMN1; SMN2NPC1RAB9APTPN1 | |
| SCHEMBL29489791 | 0.76 | PTPN1 (0.71) | ALDH1A1SMN1; SMN2NPC1RAB9APTPN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6180651-B1 | ANTIINFLAMMATORY AGENTS; ANALGESICS | BRISTOL-MYERS SQUIBB | 2001-01-30 | — | — | US | disclosed |
| US-5807873-A | Diarylmethylidenefuran derivatives and their uses in therapeutics | LABORATORIES UPSA (FR) | 1998-09-15 | — | — | US | disclosed |