Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 4/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 2/20 | 0.34 |
| ▸ | ECE1 | P42892 | 1/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.34 |
| ▸ | KDR | P35968 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8924096 | 1.00 | ADRB1 (0.36) | ADRB1ADRB3KDM4EALDH1A1TP53 | |
| SCHEMBL8922872 | 0.87 | MME (0.46) | KDM4EALDH1A1TP53MAPTHPGD | |
| SCHEMBL8922845 | 0.87 | MME (0.46) | KDM4EALDH1A1TP53MAPTHPGD | |
| SCHEMBL8923691 | 0.85 | ROCK2 (0.36) | ADRB1ADRB3MMEECE1AGTR2 | |
| SCHEMBL8923716 | 0.85 | ROCK2 (0.36) | ADRB1ADRB3MMEECE1AGTR2 | |
| SCHEMBL8924880 | 0.84 | KDM4E (0.38) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL8924951 | 0.84 | KDM4E (0.38) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL8920285 | 0.84 | ECE1 (0.46) | ADRB1ADRB3MMEECE1AGTR2 | |
| SCHEMBL8920227 | 0.84 | ECE1 (0.46) | ADRB1ADRB3MMEECE1AGTR2 | |
| SCHEMBL8920186 | 0.83 | ADRB1 (0.34) | ADRB1ADRB3MMEECE1AGTR2 |
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-0660840-B1 | PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES | CIBA GEIGY AG (CH) | 1997-05-07 | — | — | EP | disclosed |
| US-5550119-A | ENDOTHELIN-CONVERTING ENZYM INHIBITORS | CIBA-GEIGY CORPORATION (US) | 1996-08-27 | — | — | US | disclosed |
| US-5273990-A | 5-Phosphonomethyleneamino aryl-substitued alkylene-1H-tetazoles | CIBA-GEIGY CORPORATION (US) | 1993-12-28 | — | — | US | disclosed |