Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | CCR1 | P32246 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4790311 | 0.94 | CCR1 (0.36) | ALDH1A1TSHRACHETAAR1HTR2A | |
| SCHEMBL4788471 | 0.91 | CHRM3 (0.37) | ALDH1A1TSHRTAAR1HTR2AHTR2C | |
| SCHEMBL4788452 | 0.87 | TSHR (0.36) | ALDH1A1TSHRACHETAAR1HTR2A | |
| SCHEMBL4790212 | 0.85 | MAPT (0.36) | ALDH1A1TSHRTAAR1TRPM8CALM1 | |
| SCHEMBL4789864 | 0.85 | CHRM3 (0.37) | ALDH1A1TSHRACHETRPM8TDP1 | |
| SCHEMBL4788570 | 0.84 | CHRM3 (0.38) | ALDH1A1TSHRACHETAAR1CHRM3 | |
| SCHEMBL4788351 | 0.82 | ALDH1A1 (0.34) | ALDH1A1TSHRACHETAAR1HTR2A | |
| SCHEMBL4790547 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRKCNA3 | |
| SCHEMBL4789873 | 0.80 | CHRM3 (0.39) | ALDH1A1TSHRACHETAAR1HTR2A | |
| SCHEMBL4789383 | 0.80 | CHRM3 (0.36) | ALDH1A1TSHRTAAR1HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008117229-A1 | MUSCARINIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2008-10-02 | — | — | WO | claimed |
| WO-2008117229-A1 | MUSCARINIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2008-10-02 | — | — | WO | disclosed |