Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.55 |
| ▸ | CA2 | P00918 | 5/20 | 0.55 |
| ▸ | CA7 | P43166 | 4/20 | 0.55 |
| ▸ | CA4 | P22748 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11765759 | 1.00 | CA1 (0.55) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL29204442 | 1.00 | CA1 (0.55) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL11072694 | 0.84 | CA1 (0.54) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL11072695 | 0.84 | CA1 (0.54) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL2174834 | 0.83 | CA2 (0.54) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL2174838 | 0.83 | CA2 (0.54) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL3941336 | 0.82 | CA1 (0.53) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL20893356 | 0.82 | CA1 (0.53) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL3941339 | 0.82 | CA1 (0.53) | CA1CA2CA7CA4MEN1 | |
| SCHEMBL9723582 | 0.82 | CA1 (0.52) | CA1CA2CA7CA4MEN1 |
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-4042706-A | Novel anti-inflammatory pyrazole derivatives and preparation thereof | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-08-16 | — | — | US | disclosed |