Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.37 |
| ▸ | MMP12 | P39900 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11087145 | 0.83 | EGFR (0.49) | ARALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL11091741 | 0.81 | TNKS (0.44) | ARALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL1176530 | 0.80 | ALDH1A1 (0.58) | ARALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL11084251 | 0.80 | NPC1 (0.54) | ARALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL12867865 | 0.79 | PRKDC (0.51) | ALDH1A1KDM4EHPGDEGFR | |
| SCHEMBL11084232 | 0.78 | PTGS2 (0.45) | EGFRPTGS2 | |
| SCHEMBL11092009 | 0.75 | NPC1 (0.50) | ARALDH1A1HPGDRAB9AMAPT | |
| SCHEMBL70569 | 0.70 | KDM4E (0.52) | ALDH1A1KDM4EHPGDGLAMAPT | |
| SCHEMBL3533472 | 0.68 | PTGER4 (0.77) | ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL11646687 | 0.68 | KDM4E (0.50) | ALDH1A1KDM4EHPGDGLAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4471129-A | ANTIHISTAMINES | LILLY INDUSTRIES LIMITED (GB) | 1984-09-11 | — | — | US | disclosed |
| US-4448787-A | ANTIALLERGENS | LILLY INDUSTRIES LIMITED (GB) | 1984-05-15 | — | — | US | disclosed |
| US-4304728-A | 2,6-DIHYDROXY-2,5-HEXADIENOIC ACID DERIVATIVES, ANTIHISTAMINE INTERMEDIATES | LILLY INDUSTRIES LIMITED (GB) | 1981-12-08 | — | — | US | disclosed |