Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.50 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7951734 | 0.89 | MTNR1A (0.55) | MTNR1AHTR2ASMYD3RET | |
| SCHEMBL18668694 | 0.87 | MTNR1A (0.46) | MTNR1AHTR2AHRH1SMYD3IDO1 | |
| SCHEMBL3972852 | 0.86 | MTNR1A (0.52) | MTNR1AHTR2AHRH1SMYD3RET | |
| Hydrochloric Acid SCHEMBL6442427 | 0.84 | MTNR1A (0.51) | MTNR1AHTR2AHRH1SMYD3IDO1 | |
| SCHEMBL4728695 | 0.83 | MTNR1A (0.50) | MTNR1AHTR2ASMYD3 | |
| SCHEMBL4138599 | 0.83 | MTNR1A (0.57) | MTNR1ASMYD3 | |
| SCHEMBL7381467 | 0.82 | HTR2A (0.46) | HTR2AHRH1IDO1 | |
| SCHEMBL4138679 | 0.80 | MTNR1A (0.48) | MTNR1A | |
| SCHEMBL4045997 | 0.80 | MTNR1A (0.55) | MTNR1ASMYD3 | |
| SCHEMBL4729455 | 0.80 | MTNR1A (0.48) | MTNR1AHTR2ASMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1633348-A1 | 4- BROMO - 5 - (2- CHLORO - BENZOYLAMINO) - 1H - PYRAZOLE - 3 - CARBOXYLIC ACID AMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ B sb 1 /sb RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES | Elan Pharmaceuticals, Inc. (US) | 2006-03-15 | — | — | EP | disclosed |
| WO-2004098589-A1 | 4- BROMO - 5 - (2- CHLORO - BENZOYLAMINO) - 1H - PYRAZOLE - 3 - CARBOXYLIC ACID AMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ B1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES | ELAN PHARMACEUTICALS, INC. (US) | 2004-11-18 | — | — | WO | disclosed |