Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.55 |
| ▸ | NOD1 | Q9Y239 | 3/20 | 0.54 |
| ▸ | TNF | P01375 | 2/20 | 0.54 |
| ▸ | NOD2 | Q9HC29 | 2/20 | 0.54 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.54 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.54 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL979423 | 1.00 | HTT (0.62) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL990194 | 0.83 | HTT (0.67) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL14891383 | 0.80 | HTT (0.63) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL6199065 | 0.80 | CXCR4 (0.85) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL13071432 | 0.79 | CYP2C9 (0.44) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL6694492 | 0.78 | HTT (0.70) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL1707588 | 0.78 | KDM4E (0.44) | HTTCYP1A2CYP2D6POLBKMT2A | |
| SCHEMBL21311239 | 0.78 | HTT (0.59) | HTTCYP1A2CYP2D6CXCR4POLB | |
| SCHEMBL4766707 | 0.77 | MEN1 (0.62) | HTTCYP1A2CYP2D6POLBTNF | |
| SCHEMBL1992429 | 0.77 | CYP1A2 (1.00) | HTTCYP1A2CYP2D6CXCR4POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2440295-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS TRPM8 CHANNEL MODULATORS | Janssen Pharmaceutica, N.V. (BE) | 2012-04-18 | — | — | EP | disclosed |
| WO-2010144679-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS TRPM8 CHANNEL MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-16 | — | — | WO | disclosed |