Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | PTPRF | P10586 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | USP2 | O75604 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL454948 | 0.81 | HPGD (0.53) | HPGDFYNHTTUSP2MAOB | |
| Hydrochloric Acid SCHEMBL6298681 | 0.79 | HPGD (0.51) | HPGDFYNHTTUSP2MAOB | |
| SCHEMBL5693046 | 0.79 | HPGD (0.68) | HPGDFYNMEN1KMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL5850498 | 0.78 | HPGD (0.66) | HPGDFYNMEN1KMT2AKDM4E | |
| SCHEMBL6421867 | 0.78 | MEN1 (0.52) | HPGDCYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL31744631 | 0.77 | MAPT (0.57) | HPGDMEN1KMT2AHTTFFAR1 | |
| SCHEMBL5612775 | 0.76 | HPGD (0.62) | HPGDFYNMEN1KMT2ACLK4 | |
| N-Benzylaniline SCHEMBL7840 | 0.75 | HTT (0.71) | CYP1A2CYP3A4MEN1KMT2ACYP2C19 | |
| SCHEMBL2065031 | 0.75 | CYP1A2 (0.69) | CYP1A2CYP3A4MEN1KMT2ACYP2C19 | |
| SCHEMBL22628164 | 0.75 | HTT (0.71) | CYP1A2CYP3A4MEN1KMT2ACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5837702-A | HAVING POTASSIUM CHANNEL ACTIVATING ACTIVITY USEFUL AS CARDIOVASCULAR AGENTS AND TREATMENT OF ISCHEMIA | BRISTOL-MYERS SQUIBB CO. (US) | 1998-11-17 | — | — | US | disclosed |
| EP-0648758-A1 | 4-Arylamino-benzopyran and related compounds | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-04-19 | — | — | EP | disclosed |