Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 9/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.34 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9704184 | 0.93 | HTR4 (0.44) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7322685 | 0.85 | CYP2C9 (0.51) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7340946 | 0.83 | HTR4 (0.47) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7325668 | 0.83 | OPRM1 (0.37) | HTR4AGTR1 | |
| SCHEMBL7301885 | 0.74 | HTR4 (0.67) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7300816 | 0.73 | HTR4 (0.54) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL16504002 | 0.66 | CYP2C9 (0.66) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7302781 | 0.65 | HTR4 (0.45) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7301907 | 0.65 | CYP2C9 (0.53) | HTR4CYP1A2CYP2C9ALOX15NFKB1 | |
| SCHEMBL7304670 | 0.64 | KDM1A (0.46) | AGTR1 |
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-0501322-B1 | 3-Piperidinylmethylcarboxylate substituted indoles | GLAXO GROUP LTD (GB) | 1996-09-04 | — | — | EP | disclosed |
| WO-1992014727-A1 | 3-PIPERIDINYLMETHYLCARBOXYLATE SUBSTITUTED INDOLES | GLAXO GROUP LIMITED (GB) | 1992-09-03 | — | — | WO | disclosed |
| EP-0501322-A1 | 3-Piperidinylmethylcarboxylate substituted indoles | GLAXO GROUP LIMITED (GB) | 1992-09-02 | — | — | EP | disclosed |