Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 3/20 | 0.50 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.50 |
| ▸ | CCR5 | P51681 | 2/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8893424 | 0.81 | CCR5 (0.51) | SLC6A9SLC6A5CCR5HPGDOPRM1 | |
| SCHEMBL8894056 | 0.77 | BDKRB2 (0.59) | EPHX1BACE1BDKRB2CTSD | |
| SCHEMBL27152573 | 0.76 | CCR5 (0.53) | CCR5EPHX1HPGDKDM4EMAPT | |
| SCHEMBL17141012 | 0.76 | DDB1 (0.46) | CCR5BACE1HPGDKDM4EMAPT | |
| SCHEMBL5561690 | 0.75 | SLC6A9 (0.67) | SLC6A9SLC6A5OPRM1OPRD1OPRK1 | |
| SCHEMBL27148210 | 0.74 | CCR5 (0.48) | CCR5HPGDKDM4EMAPTTHRB | |
| SCHEMBL1969568 | 0.72 | EPHX1 (0.54) | EPHX1HPGDMAPT | |
| SCHEMBL22770523 | 0.70 | DDB1 (0.43) | BACE1HPGDKDM4EMAPTTHRB | |
| SCHEMBL1307642 | 0.70 | EPHX1 (0.51) | EPHX1HPGDKDM4EMAPTDDB1 | |
| SCHEMBL4476343 | 0.70 | CCR5 (0.47) | CCR5EPHX1BACE1HPGDKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5610142-A | Bradykinin antagonist pseudopeptide derivatives of substituted 4-keto-1,3,8-triazaspiro[4.5]decan-3-alkanoic acids | SCIOS INC. (US) | 1997-03-11 | — | — | US | disclosed |