Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28496768 | 0.86 | CYP1A2 (0.33) | NPC1HSP90AA1L3MBTL1CYP1A2CYP2A6 | |
| SCHEMBL15821385 | 0.73 | MAOA (0.33) | CYP1A2CYP2A6 | |
| SCHEMBL668081 | 0.71 | CYP1A2 (0.48) | L3MBTL1CYP1A2CYP2A6 | |
| SCHEMBL2409495 | 0.71 | CYP2A6 (0.33) | CYP1A2CYP2A6 | |
| SCHEMBL24104 | 0.69 | HPRT1 (0.35) | CYP1A2CYP2A6 | |
| SCHEMBL2407351 | 0.69 | HPRT1 (0.35) | CYP1A2CYP2A6 | |
| SCHEMBL4824194 | 0.69 | HPRT1 (0.35) | CYP1A2CYP2A6 | |
| SCHEMBL1556594 | 0.69 | CYP1A2 (0.41) | L3MBTL1CYP1A2CYP2A6AHR | |
| SCHEMBL4584867 | 0.68 | SMN1; SMN2 (0.36) | NPC1L3MBTL1 | |
| SCHEMBL28986864 | 0.67 | GPR3 (0.42) | CYP1A2 |
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-0658585-B1 | Aminophenylalanine derivatives, process for their production, their use and agents containing them as anti-coagulants | STUEBER WERNER (DE) | 2000-07-19 | — | — | EP | disclosed |
| CN-1039125-C | Amidinophenylalanine derivatives and process for preparing same and use | REHRINGWERKE AG (DE) | 1998-07-15 | — | — | CN | disclosed |
| US-5571844-A | Amidinophenylalanine derivatives, a process for their preparation, their use and compositions containing these as anticoagulants | BEHRINGWERKE AKTIENGESELLSCHAFT (DE) | 1996-11-05 | — | — | US | disclosed |
| EP-0513543-B1 | Derivatives of amidinophenylalanine, procedure for their preparation, their utilisation and anticoagulant compositions comprising them. | BEHRINGWERKE AG (DE) | 1995-10-25 | — | — | EP | disclosed |
| EP-0658585-A2 | Aminophenylalanine derivatives, process for their production, their use and agents containing them as anti-coagulants | BEHRINGWERKE Aktiengesellschaft (DE) | 1995-06-21 | — | — | EP | disclosed |
| CN-1067249-A | Amidinophenylalaninederivatives derivatives and Preparation Method And The Use | BEHRINGWERKE AG (DE) | 1992-12-23 | — | — | CN | disclosed |
| EP-0513543-A1 | Derivatives of amidinophenylalanine, procedure for their preparation, their utilisation and anticoagulant compositions comprising them. | BEHRINGWERKE Aktiengesellschaft (DE) | 1992-11-19 | — | — | EP | disclosed |