Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.47 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.47 |
| ▸ | GGT1 | P19440 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL25788066 | 0.89 | ALDH1A1 (0.84) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL6042573 | 0.89 | ALDH1A1 (0.84) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL6043026 | 0.88 | ALDH1A1 (0.76) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL1505142 | 0.87 | ALDH1A1 (0.74) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL26355092 | 0.86 | ALDH1A1 (0.73) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL2451818 | 0.86 | ALDH1A1 (0.63) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL8945692 | 0.85 | NPC1 (0.48) | ALDH1A1KMT2APTK2BKDM4ELMNA | |
| SCHEMBL2290756 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL31037191 | 0.82 | RARG (0.48) | ALDH1A1KMT2APTK2BHSD17B10TSHR | |
| SCHEMBL3383338 | 0.82 | ALDH1A1 (0.67) | ALDH1A1KMT2APTK2BKDM4EHTT |
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-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |