Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 11/20 | 0.40 |
| ▸ | MMP9 | P14780 | 11/20 | 0.40 |
| ▸ | MMP8 | P22894 | 4/20 | 0.40 |
| ▸ | MMP13 | P45452 | 4/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | BAX | Q07812 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10448280 | 0.87 | ADAM17 (0.44) | PARP10ADAM17AKR1C1 | |
| SCHEMBL10659448 | 0.86 | AKR1C1 (0.48) | AKR1C1 | |
| SCHEMBL994596 | 0.86 | AKR1C1 (0.48) | AKR1C1 | |
| SCHEMBL435512 | 0.86 | AKR1C1 (0.48) | AKR1C1 | |
| Hydrochloric Acid SCHEMBL8114401 | 0.84 | AKR1C1 (0.47) | AKR1C1 | |
| Hydrochloric Acid SCHEMBL8114403 | 0.84 | AKR1C1 (0.47) | AKR1C1 | |
| SCHEMBL15664683 | 0.84 | TET3 (0.42) | — | |
| SCHEMBL11241224 | 0.83 | AKR1C1 (0.40) | AKR1C1 | |
| Hydrochloric Acid SCHEMBL11247968 | 0.82 | AKR1C1 (0.39) | AKR1C1 | |
| SCHEMBL16057460 | 0.81 | AKR1C1 (0.52) | AKR1C1 |
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-4316905-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1982-02-23 | — | — | US | disclosed |