Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 6/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1399903 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CXCR3SMN1; SMN2MAPTHPGD | |
| SCHEMBL29359406 | 0.79 | HRH4 (0.46) | ALDH1A1CYP11B1CYP11B2HRH4HRH3 | |
| SCHEMBL8206338 | 0.78 | ALDH1A1 (0.49) | ALDH1A1CXCR3SMN1; SMN2MAPTPOLB | |
| SCHEMBL112394 | 0.78 | ALDH1A1 (0.49) | ALDH1A1CXCR3SMN1; SMN2MAPTPOLB | |
| SCHEMBL21494752 | 0.78 | KMT2A (0.47) | ALDH1A1CXCR3SMN1; SMN2MAPTPOLB | |
| SCHEMBL6806443 | 0.78 | ALDH1A1 (0.49) | ALDH1A1CXCR3SMN1; SMN2MAPTPOLB | |
| SCHEMBL111084 | 0.78 | ALDH1A1 (0.49) | ALDH1A1CXCR3SMN1; SMN2MAPTPOLB | |
| SCHEMBL12073747 | 0.78 | ESR1 (0.50) | ALDH1A1CXCR3MAPTPOLBHPGD | |
| Hydrochloric Acid SCHEMBL3407515 | 0.77 | ALDH1A1 (0.48) | ALDH1A1CXCR3SMN1; SMN2MAPTPOLB | |
| SCHEMBL6470542 | 0.77 | MAPT (0.51) | ALDH1A1CYP3A4CXCR3SMN1; SMN2MAPT |
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-2008042867-A2 | MODULATORS OF MULTIPLE KINASES | EMILIEM INC. (US) | 2008-04-10 | — | — | WO | disclosed |