Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | STS | P08842 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11601527 | 0.86 | TDP1 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11602773 | 0.83 | ICAM1 (0.48) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11603129 | 0.83 | MAPT (0.55) | TRPV1CA12CA1CA2CA7 | |
| SCHEMBL17185277 | 0.80 | HSD17B2 (0.47) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27371998 | 0.80 | CA12 (0.50) | CHEK2CA12CA1CA2CA7 | |
| SCHEMBL4506078 | 0.80 | PTGS2 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL15354404 | 0.78 | HTR2A (0.54) | CHEK2MAPTKDM4ECYP1A2CYP3A4 | |
| SCHEMBL203843 | 0.78 | CA12 (0.68) | TRPV1CA12CA1CA2CA7 | |
| SCHEMBL8656770 | 0.78 | CA12 (0.68) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6437986 | 0.78 | CA12 (0.54) | CA12CA1CA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4098816-A | HYPOGLYCEMIC AGENTS AND ANTILIPEMIC AGENTS | BEECHAM GROUP LIMITED (GB) | 1978-07-04 | — | — | US | disclosed |