Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 3/20 | 0.47 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8371979 | 1.00 | CYP17A1 (0.47) | CYP17A1PSMB8NAMPTPPARGPPARA | |
| SCHEMBL13055402 | 0.83 | CYP17A1 (0.59) | CYP17A1PSMB8NAMPTPTPN11CA12 | |
| SCHEMBL7262058 | 0.82 | CYP17A1 (0.46) | CYP17A1PSMB8NAMPTPPARGPPARA | |
| SCHEMBL30479003 | 0.81 | ABCG2 (0.45) | CA12CA1CA9NPC1RAB9A | |
| SCHEMBL5726217 | 0.81 | NR1H4 (0.57) | CYP17A1PSMB8NAMPTPPARGPPARA | |
| SCHEMBL5726593 | 0.81 | NR1H4 (0.57) | CYP17A1PSMB8NAMPTPPARGPPARA | |
| SCHEMBL1000734 | 0.81 | NR1H4 (0.57) | CYP17A1PSMB8NAMPTPPARGPPARA | |
| SCHEMBL9479696 | 0.79 | MAPT (0.58) | CYP17A1NAMPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL104556 | 0.79 | RAB9A (0.55) | CYP17A1PSMB8NAMPTCA12CA1 | |
| SCHEMBL11087232 | 0.78 | NAMPT (0.48) | CYP17A1PSMB8NAMPTPPARGPPARA |
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-0703900-B1 | PROCESS FOR THE PREPARATION OF PHENYLALANINE DERIVATIVES OR HOMOLOGUES CONTAINING A GUANIDINO OR MODIFIED GUANIDINO GROUP USEFUL FOR THE PREPARATION GnRH OF ANTAGONISTIC PEPTIDES | SALK INST FOR BIOLOGICAL STUDI (US) | 1999-02-24 | — | — | EP | disclosed |
| EP-0703900-A1 | PROCESS FOR THE PREPARATION OF PHENYLALANINE DERIVATIVES OR HOMOLOGUES CONTAINING A GUANIDINO OR MODIFIED GUANIDINO GROUP USEFUL FOR THE PREPARATION GnRH OF ANTAGONISTIC PEPTIDES | THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) | 1996-04-03 | — | — | EP | disclosed |
| WO-1995000474-A1 | PROCESS FOR THE PREPARATION OF PHENYLALANINE DERIVATIVES OR HOMOLOGUES CONTAINING A GUANIDINO OR MODIFIED GUANIDINO GROUP USEFUL FOR THE PREPARATION GnRH OF ANTAGONISTIC PEPTIDES | THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) | 1995-01-05 | — | — | WO | disclosed |