Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 3/20 | 0.78 |
| ▸ | THRA | P10827 | 2/20 | 0.70 |
| ▸ | THRB | P10828 | 2/20 | 0.70 |
| ▸ | CYP24A1 | Q07973 | 6/20 | 0.64 |
| ▸ | CYP27A1 | Q02318 | 3/20 | 0.64 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.64 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.64 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | CCR6 | P51684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8012038 | 1.00 | METAP1 (0.78) | METAP1THRATHRBCYP24A1CYP27A1 | |
| Hydrochloric Acid SCHEMBL10341505 | 0.99 | METAP1 (0.78) | METAP1THRATHRBCYP24A1CYP27A1 | |
| SCHEMBL7590969 | 0.92 | METAP1 (0.74) | METAP1THRATHRBCYP24A1CYP27A1 | |
| SCHEMBL11011369 | 0.89 | METAP1 (0.76) | METAP1THRATHRBCYP24A1CYP27A1 | |
| Hydrochloric Acid SCHEMBL4623159 | 0.88 | METAP1 (0.78) | METAP1THRATHRBCYP24A1CYP27A1 | |
| SCHEMBL3827392 | 0.87 | METAP1 (1.00) | METAP1THRATHRBCYP24A1CYP26A1 | |
| SCHEMBL8014606 | 0.86 | METAP1 (0.59) | METAP1THRATHRBCYP24A1CYP27A1 | |
| SCHEMBL7592165 | 0.86 | METAP1 (0.59) | METAP1THRATHRBCYP24A1CYP27A1 | |
| SCHEMBL630276 | 0.86 | CYP24A1 (0.70) | METAP1THRATHRBCYP24A1CYP27A1 | |
| SCHEMBL14159089 | 0.84 | CYP24A1 (0.69) | METAP1THRATHRBCYP24A1CYP27A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0864559-B1 | Substituted amino compounds and their use as analgesic active substances | GRUENENTHAL GMBH (DE) | 2002-06-05 | — | — | EP | disclosed |
| US-6022895-A | Substituted amino compounds and their use as substances having an analgesic effect | GRUENENTHAL GMBH (DE) | 2000-02-08 | — | — | US | disclosed |
| EP-0864559-A1 | Substituted amino compounds and their use as analgesic active substances | Grünenthal GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| US-5215989-A | Nitrogen-containing heterocyclic compounds as class III antiarrhythmic agents | MERCK & CO., INC. (US) | 1993-06-01 | — | — | US | disclosed |
| US-5032598-A | Nitrogens containing heterocyclic compounds as class III antiarrhythmic agents | MERCK & CO., INC. (US) | 1991-07-16 | — | — | US | disclosed |
| EP-0431945-A2 | Antiarrhythmic agents | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |
| US-4051248-A | CENTRAL NERVOUS SYSTEM DEPRESSANTS, NEUROLEPTIC AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1977-09-27 | — | — | US | disclosed |