Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 4/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HTR4 | Q13639 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HRH2 | P25021 | 2/20 | 0.46 |
| ▸ | HTR3A | P46098 | 6/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7305753 | 0.90 | CNR1 (0.52) | CNR1CNR2CYP2C9PMP22NPSR1 | |
| SCHEMBL7301718 | 0.87 | HTR4 (0.62) | CNR1CNR2CYP2C9PMP22NPSR1 | |
| SCHEMBL7301907 | 0.79 | CYP2C9 (0.53) | CNR2CYP2C9PMP22NPSR1MEN1 | |
| SCHEMBL27562653 | 0.79 | CNR1 (0.52) | CNR1CNR2HRH2 | |
| SCHEMBL7300888 | 0.78 | HTR4 (0.77) | CYP2C9PMP22NPSR1MEN1LMNA | |
| SCHEMBL4294889 | 0.78 | HTR4 (0.61) | CNR1CNR2CYP2C9PMP22NPSR1 | |
| SCHEMBL7303226 | 0.78 | CYP2C9 (0.49) | CYP2C9PMP22NPSR1MEN1LMNA | |
| Hydrochloric Acid SCHEMBL7291228 | 0.78 | HTR4 (0.76) | CYP2C9PMP22NPSR1MEN1LMNA | |
| SCHEMBL7358522 | 0.77 | HTR4 (0.60) | CYP2C9PMP22NPSR1MEN1LMNA | |
| SCHEMBL7358517 | 0.76 | CYP2C9 (0.49) | CYP2C9PMP22NPSR1MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0501322-B1 | 3-Piperidinylmethylcarboxylate substituted indoles | GLAXO GROUP LTD (GB) | 1996-09-04 | — | — | EP | claimed |