Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 11/20 | 0.42 |
| ▸ | BCL9 | O00512 | 10/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | BCL9L | Q86UU0 | 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 | |
|---|---|---|---|---|
| SCHEMBL19404305 | 0.86 | TTR (0.56) | TTRADRB1CHRM2CHRM4CHRM1 | |
| SCHEMBL19386237 | 0.84 | CHRNB2 (0.55) | TTRADRB1CHRM2CHRM4CHRM1 | |
| SCHEMBL7229124 | 0.84 | ADRB1 (0.46) | TTRADRB1CHRM2CHRM4CHRM1 | |
| SCHEMBL19404236 | 0.83 | CTNNB1 (0.53) | CTNNB1BCL9BCL9L | |
| SCHEMBL8259537 | 0.83 | SMN1; SMN2 (0.53) | TTRALDH1A1HSD17B10 | |
| SCHEMBL6629680 | 0.81 | MAPT (0.49) | TTRMAOBALDH1A1TSHR | |
| SCHEMBL3045513 | 0.79 | ADRB1 (0.57) | ADRB1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL12187540 | 0.79 | ADRB1 (0.47) | ADRB1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL26181620 | 0.78 | ALDH1A1 (0.43) | ADRB1CHRM2CHRM4CHRM1CHRM3 | |
| Hydrochloric Acid SCHEMBL6973293 | 0.77 | ADRB1 (0.55) | ADRB1CHRM2CHRM4CHRM1CHRM3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006077424-A1 | PHARMACEUTICAL COMPOUNDS | ASTEX THERAPEUTICS LIMITED (GB) | 2006-07-27 | — | — | WO | disclosed |
| WO-2006077428-A1 | PHARMACEUTICAL COMPOUNDS | ASTEX THERAPEUTICS LIMITED (GB) | 2006-07-27 | — | — | WO | disclosed |
| WO-2006077419-A1 | PYRAZOLE DERIVATIVES FOR THE INHIBITION OF CDK' S AND GSK' S | ASTEX THERAPEUTICS LIMITED (GB) | 2006-07-27 | — | — | WO | disclosed |