Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MLNR | O43193 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | FPR1 | P21462 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9965448 | 0.86 | BRD4 (0.42) | CHRM3CYP3A4BRD4KMT2AACHE | |
| SCHEMBL3571524 | 0.84 | CHRM3 (0.44) | CHRM3CHRM2CHRM1POLBKDM4E | |
| SCHEMBL9965412 | 0.81 | MLNR (0.47) | CHRM3CHRM2CHRM1MLNRCYP3A4 | |
| Hydrochloric Acid SCHEMBL30790524 | 0.76 | CHRM3 (0.53) | CHRM3CHRM2CHRM1CYP3A4BRD4 | |
| SCHEMBL14639871 | 0.75 | PKM (0.39) | POLBKMT2AKDM4EGAATDP1 | |
| SCHEMBL331240 | 0.72 | CHRM3 (0.49) | CHRM3CHRM2CHRM1BRD4IKBKB | |
| SCHEMBL13801296 | 0.71 | MAPK3 (0.46) | BRD4KMT2AKDM4EGAAMAPK1 | |
| SCHEMBL30789799 | 0.71 | ACHE (0.40) | MLNRCYP3A4KDM4EGAAACHE | |
| SCHEMBL29127243 | 0.70 | ALDH1A1 (0.49) | CHRM3CYP3A4KMT2AKDM4EGAA | |
| SCHEMBL27927468 | 0.70 | CARM1 (0.51) | POLBBRD4KDM4E |
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-2007003934-A2 | 17BETA-HYDR0XYSTER0ID DEHYDROGENASE TYPE 3 (17BETA-HSD3 ) INHIBITORS | STERIX LIMITED (GB) | 2007-01-11 | — | — | WO | disclosed |