Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | SRD5A1 | P18405 | 5/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL761220 | 0.81 | SRD5A1 (0.54) | SRD5A1CHRM2CHRM4CHRM1CHRM3 | |
| Hydrochloric Acid SCHEMBL27632990 | 0.79 | SRD5A1 (0.53) | SRD5A1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL677619 | 0.78 | MEN1 (0.50) | NOTUMSRD5A1TSHRBRPF1 | |
| SCHEMBL29946500 | 0.78 | MEN1 (0.50) | NOTUMSRD5A1BRPF1 | |
| SCHEMBL678115 | 0.78 | MEN1 (0.50) | NOTUMSRD5A1BRPF1 | |
| SCHEMBL19224516 | 0.77 | BRD4 (0.44) | NOTUMRAB9AMTNR1ATSHRDRD4 | |
| SCHEMBL20073949 | 0.75 | KMT2A (0.46) | NOTUMNPC1RAB9ATSHR | |
| SCHEMBL21120469 | 0.73 | MEN1 (0.47) | NOTUMSRD5A1BRPF1 | |
| SCHEMBL25556401 | 0.73 | DRD4 (0.48) | SRD5A1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL13502655 | 0.73 | DRD4 (0.48) | SRD5A1CHRM2CHRM4CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018069732-A1 | HETEROCYCLIC COMPOUNDS HAVING ACTIVITY AS MODULATORS OF MUSCARINIC M1 AND/OR M4 RECEPTORS IN THE TREATMENT OF CNS DISEASES AND PAINS. | HEPTARES THERAPEUTICS LIMITED (GB) | 2018-04-19 | — | — | WO | disclosed |