Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 3/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL979263 | 0.77 | HTR3A (0.38) | PTGS1HTR3AKMT2AMAPTALDH1A1 | |
| SCHEMBL248731 | 0.72 | L3MBTL1 (0.39) | KMT2AALDH1A1MEN1 | |
| SCHEMBL186256 | 0.72 | PTGS1 (0.49) | PTGS1KMT2ACYP2C9ALDH1A1HPGD | |
| SCHEMBL26122020 | 0.70 | HAO1 (0.46) | CYP2C9MAPTALDH1A1HPGDCYP2C19 | |
| SCHEMBL9707251 | 0.70 | HAO1 (0.46) | — | |
| SCHEMBL17582560 | 0.69 | PTGS1 (0.46) | PTGS1HTR3AKMT2ACYP1A2MAPT | |
| SCHEMBL14856800 | 0.69 | HAO1 (0.38) | KMT2ACYP1A2CYP2C9MAPTHPGD | |
| SCHEMBL4078995 | 0.68 | ATM (0.47) | PTGS1MAPTALDH1A1HPGDLMNA | |
| SCHEMBL686904 | 0.68 | KMT2A (0.40) | KMT2AMAPTMEN1 | |
| SCHEMBL15768034 | 0.67 | KMT2A (0.40) | KMT2ACYP1A2MAPTALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |
| EP-2401256-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097372-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |