Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 3/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16072425 | 0.87 | CHRM1 (0.61) | CHRM1CHRM4TSHRLMNACHRM2 | |
| SCHEMBL21179983 | 0.82 | HTR3E (0.56) | CHRM1CHRM4TSHRLMNACHRM2 | |
| SCHEMBL6105382 | 0.79 | STS (0.46) | CHRM1CHRM4TSHRLMNACHRM2 | |
| SCHEMBL6105386 | 0.79 | STS (0.46) | CHRM1CHRM4TSHRLMNACHRM2 | |
| SCHEMBL26081883 | 0.79 | CHRM1 (0.78) | CHRM1CHRM4TSHRLMNACHRM2 | |
| SCHEMBL13175813 | 0.76 | CHRM2 (0.54) | CHRM1CHRM4LMNACHRM2CHRM5 | |
| SCHEMBL13698870 | 0.75 | HTR3E (0.63) | CHRM1CHRM4LMNACHRM2CHRM5 | |
| SCHEMBL5790060 | 0.75 | HTR3E (0.63) | CHRM1CHRM4LMNACHRM2CHRM5 | |
| SCHEMBL5791676 | 0.75 | HTR3E (0.63) | CHRM1CHRM4LMNACHRM2CHRM5 | |
| SCHEMBL24475293 | 0.75 | STS (0.47) | CHRM1CHRM2CHRM3STS |
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-3344626-B9 | THERAPEUTIC COMPOUNDS FOR PAIN AND SYNTHESIS THEREOF | JANSSEN PHARMACEUTICA NV (BE) | 2021-08-11 | — | — | EP | disclosed |
| EP-3344627-B9 | THERAPEUTIC COMPOUNDS FOR PAIN AND SYNTHESIS THEREOF | JANSSEN PHARMACEUTICA NV (BE) | 2021-08-04 | — | — | EP | disclosed |