Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7415791 | 1.00 | HIF1A (0.56) | HIF1ACYP2C19CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL27908890 | 0.88 | SMN1; SMN2 (0.57) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL447459 | 0.84 | CYP2C19 (0.50) | HIF1ACYP2C19CYP2D6TSHRALDH1A1 | |
| SCHEMBL21834964 | 0.84 | ALDH1A1 (0.47) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL21835010 | 0.84 | ALDH1A1 (0.47) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL3270164 | 0.82 | PPARA (0.55) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL24236743 | 0.82 | CYP2C19 (0.46) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL24236754 | 0.82 | CYP2C19 (0.46) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL24236757 | 0.82 | CYP2C19 (0.46) | HIF1ACYP2C19CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL27566095 | 0.81 | SMN1; SMN2 (0.43) | HIF1ACYP2C19CYP2D6TSHRSMN1; SMN2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4698411-A | Polyester resins | PHILLIPS PETROLEUM COMPANY (US) | 1987-10-06 | — | — | US | claimed |
| WO-2003013526-A1 | ANTICOAGULANT COMPOUNDS | MERCK & CO. INC. (US) | 2003-02-20 | — | — | WO | disclosed |
| EP-0534492-B1 | Carboxyalkyl substituted inhibitors of enkephalinase and ACE | MERRELL PHARMA INC (US) | 1996-12-18 | — | — | EP | disclosed |
| US-5529997-A | ADMINISTERING FOR ANALGESIC, HYPOTENSIVE OR DIURETIC EFFECT OR TO TREAT CONGESTIVE HEART FAILURE OR IRRITABLE BOWEL SYNDROME | MERRELL PHARMACEUTICALS INC. (US) | 1996-06-25 | — | — | US | disclosed |
| US-5488047-A | HYPOTENSIVE AGENTS, ANALGESICS; CONGESTIVE HEART FAILURE | MERRELL DOW PHARMACEUTICALS INC. (US) | 1996-01-30 | — | — | US | disclosed |
| US-5472959-A | Hypotensive agents, congestive heart failure | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-12-05 | — | — | US | disclosed |
| US-5455242-A | Analgesics, hypotensive or cardiotonic agents, diuretics, antidepressants or suppressors of vascular response after angioplasty | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-10-03 | — | — | US | disclosed |
| EP-0534492-A2 | Carboxyalkyl substituted inhibitors of enkephalinase and ACE | MERRELL PHARMACEUTICALS INC. (US) | 1993-03-31 | — | — | EP | disclosed |
| US-4698411-A | Polyester resins | PHILLIPS PETROLEUM COMPANY (US) | 1987-10-06 | — | — | US | disclosed |