Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.47 |
| ▸ | HTR1D | P28221 | 3/20 | 0.47 |
| ▸ | HTR6 | P50406 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL8868834 | 0.88 | HTR1D (0.64) | TRPM8CYP2D6KMT2ACYP1A2HTR1D | |
| Oxalic Acid SCHEMBL8868845 | 0.82 | KMT2A (0.68) | TRPM8CYP2D6KMT2ACYP1A2HTR1D | |
| SCHEMBL8869498 | 0.82 | CYP2D6 (0.52) | TRPM8CYP2D6CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL2540892 | 0.81 | TRPM8 (0.74) | TRPM8CYP2D6CYP3A4CYP2C19KDM4E | |
| SCHEMBL8869870 | 0.81 | HTR1A (0.63) | TRPM8CYP2D6CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL8870437 | 0.81 | HTR1D (0.52) | TRPM8CYP2D6CYP3A4CYP2C19HSD17B10 | |
| Hydrochloric Acid SCHEMBL8868912 | 0.81 | TRPM8 (0.73) | TRPM8KMT2AKDM4EMEN1TSHR | |
| SCHEMBL8868844 | 0.81 | CSNK2A1 (0.51) | TRPM8CYP2D6CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL8868849 | 0.79 | SCN9A (0.43) | TRPM8CYP2D6CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL8869706 | 0.79 | TRPM8 (0.47) | TRPM8CYP2D6CYP3A4CYP2C19HSD17B10 |
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-5637593-A | MIGRAINE; HYPOTENSIVE AGENTS | SMITHKLINE BEECHAM PLC (GB) | 1997-06-10 | — | — | US | disclosed |