Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.44 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | RARB | P10826 | 1/20 | 0.42 |
| ▸ | COMT | P21964 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9053200 | 0.82 | PTGS2 (0.51) | TPMTPTGS2POLBPOLA1ANTXR2 | |
| SCHEMBL9058254 | 0.79 | HPGD (0.49) | TPMTPOLBCA1CA2ALDH1A1 | |
| SCHEMBL9058253 | 0.79 | HPGD (0.49) | TPMTPOLBCA1CA2ALDH1A1 | |
| SCHEMBL7937565 | 0.77 | PTGS2 (0.51) | TPMTPTGS2POLBPOLA1ANTXR2 | |
| SCHEMBL9055309 | 0.76 | KMT2A (0.48) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL9056610 | 0.75 | TPMT (0.41) | TPMTPTGS2GPR35TTRPOLB | |
| SCHEMBL9056672 | 0.74 | TSHR (0.33) | POLBTSHRCA12CA1CA2 | |
| SCHEMBL9052519 | 0.73 | PTGS2 (0.50) | TPMTPTGS2TTRPOLBPOLA1 | |
| SCHEMBL9056474 | 0.72 | TP53 (0.49) | POLBCA1CA2CA5AKDM4E | |
| SCHEMBL9056482 | 0.72 | TP53 (0.49) | POLBCA1CA2CA5AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996008483-A1 | GALLIC ACID DERIVATIVES, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS | ROUSSEL UCLAF (FR) | 1996-03-21 | — | — | WO | disclosed |