Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.42 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MLNR | O43193 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8557576 | 0.90 | MEN1 (0.52) | KCNH2MEN1MLNRNR1I2USP2 | |
| SCHEMBL8552887 | 0.89 | NR4A2 (0.47) | KCNH2MEN1MLNRNR1I2USP2 | |
| SCHEMBL8553475 | 0.87 | GAA (0.45) | KCNH2CACNA1GMEN1MLNRNR1I2 | |
| Hydrochloric Acid SCHEMBL8554703 | 0.86 | GAA (0.43) | KCNH2CACNA1GMEN1MLNRNR1I2 | |
| SCHEMBL8552938 | 0.81 | RXRA (0.46) | CETPKCNH2KMT2AGAAKDR | |
| SCHEMBL8555057 | 0.80 | NR4A2 (0.51) | KCNH2MEN1MLNRNR1I2USP2 | |
| SCHEMBL8554568 | 0.78 | KDR (0.58) | MEN1LMNACYP3A4DRD2HTR2A | |
| SCHEMBL8558360 | 0.78 | RXRA (0.50) | KCNH2CACNA1GMEN1MLNRNR1I2 | |
| SCHEMBL8554363 | 0.76 | KDR (0.57) | MEN1LMNAKMT2AKDRRXRA | |
| SCHEMBL8556400 | 0.76 | NR4A2 (0.41) | LMNACYP3A4DRD2HTR2AADRA1A |
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-0582164-B1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | BRISTOL MYERS SQUIBB CO (US) | 1998-12-23 | — | — | EP | claimed |
| US-5382584-A | Antiischemic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-01-17 | — | — | US | claimed |
| EP-0582164-A1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | Bristol-Myers Squibb Company (US) | 1994-02-09 | — | — | EP | claimed |