Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | AHR | P35869 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11264781 | 0.81 | CYP19A1 (0.44) | CYP19A1CYP2C19KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL11261538 | 0.76 | POLB (0.40) | CYP19A1MAPTCYP2C19RAB9ANPC1 | |
| SCHEMBL11261869 | 0.68 | CYP19A1 (0.41) | CYP19A1CYP2C19KDM4EALDH1A1HPGD | |
| SCHEMBL11629212 | 0.66 | AHR (0.55) | MAPTKDM4ERAB9ANPC1POLB | |
| SCHEMBL3524113 | 0.66 | CA1 (0.52) | MAPTKDM4ERAB9ANPC1POLB | |
| SCHEMBL7061017 | 0.64 | CA1 (0.50) | MAPTKDM4ERAB9ANPC1POLB | |
| SCHEMBL7592144 | 0.64 | CA1 (0.50) | MAPTKDM4ERAB9ANPC1POLB | |
| SCHEMBL11263713 | 0.63 | CYP19A1 (0.37) | CYP19A1CYP2C19KDM4EALDH1A1HPGD | |
| SCHEMBL8938124 | 0.63 | CYP19A1 (0.44) | CYP19A1CYP2C19ALDH1A1HPGDCYP3A4 | |
| SCHEMBL11628406 | 0.63 | CYP19A1 (0.41) | CYP19A1ALDH1A1 |
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-4327213-A | ANTIULCER AGENTS | ACF Chemiefarma VA (NL) | 1982-04-27 | — | — | US | disclosed |