Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 4/20 | 0.39 |
| ▸ | MMP9 | P14780 | 4/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | AOC2 | O75106 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 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 | |
|---|---|---|---|---|
| SCHEMBL10756276 | 1.00 | CA2 (0.42) | CA2CA1CA12CA4CA6 | |
| SCHEMBL10754508 | 1.00 | CA2 (0.42) | CA2CA1CA12CA4CA6 | |
| SCHEMBL10761071 | 0.89 | CA2 (0.39) | CA2CA1CA12CA4CA6 | |
| SCHEMBL10761948 | 0.83 | TMEM97 (0.43) | CA2MMP2MMP9TMEM97SIGMAR1 | |
| SCHEMBL10757579 | 0.83 | TMEM97 (0.43) | CA2MMP2MMP9TMEM97SIGMAR1 | |
| SCHEMBL10760060 | 0.83 | TMEM97 (0.43) | CA2MMP2MMP9TMEM97SIGMAR1 | |
| SCHEMBL2115284 | 0.82 | CRBN (0.45) | CA2MMP2MMP9AOC2MAOB | |
| SCHEMBL2115280 | 0.82 | CRBN (0.45) | CA2MMP2MMP9AOC2MAOB | |
| SCHEMBL27802097 | 0.81 | CRBN (0.44) | CA2MMP2MMP9AOC2MAOB | |
| SCHEMBL10926756 | 0.80 | MMP9 (0.54) | CA2MMP2MMP9TMEM97SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4672071-A | Antihypertensive dihydropyridine compositions, optical isomers and intermediates | SYNTEX (U.S.A.) INC. (US) | 1987-06-09 | — | — | US | disclosed |
| EP-0191448-A2 | Antihypertensive dihydropyridine derivatives | SYNTEX (U.S.A.) INC. (US) | 1986-08-20 | — | — | EP | disclosed |