Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | VCP | P55072 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL8998950 | 1.00 | ESR1 (0.52) | ESR1CES2CES1LMNAPOLB | |
| SCHEMBL15306805 | 0.90 | CES2 (0.54) | ESR1CES2CES1LMNAPOLB | |
| SCHEMBL1343904 | 0.88 | ESR1 (0.53) | ESR1CES2CES1LMNAPOLB | |
| SCHEMBL29034616 | 0.84 | SMN1; SMN2 (0.49) | ESR1LMNAPOLBNPC1RAB9A | |
| SCHEMBL8999045 | 0.82 | CES2 (0.50) | ESR1CES2CES1LMNAPOLB | |
| SCHEMBL31060887 | 0.82 | CYP19A1 (0.56) | ESR1CES2LMNARAB9AMEN1 | |
| SCHEMBL31060218 | 0.82 | CYP19A1 (0.56) | ESR1CES2LMNARAB9AMEN1 | |
| SCHEMBL31060505 | 0.82 | CYP19A1 (0.56) | ESR1CES2LMNARAB9AMEN1 | |
| SCHEMBL11756578 | 0.81 | CES2 (0.46) | ESR1CES2CES1LMNAPOLB | |
| SCHEMBL11756572 | 0.81 | CES2 (0.46) | ESR1CES2CES1LMNAPOLB |
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-5554624-A | CONGESTIVE HEART FAILURE; HYPOTENSIVE AGENTS | J. URIACH & CIA. (ES) | 1996-09-10 | — | — | US | disclosed |
| EP-0669333-A1 | New imidazopyridine derivatives as angiotensin II antagonists | J. URIACH & CIA. S.A. (ES) | 1995-08-30 | — | — | EP | disclosed |