Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA1 | P56199 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | ACLY | P53396 | 10/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | POLA1 | P09884 | 1/20 | 0.43 |
| ▸ | ANTXR2 | P58335 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SELL | P14151 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SELP | P16109 | 1/20 | 0.42 |
| ▸ | FUT4 | P22083 | 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 | |
|---|---|---|---|---|
| SCHEMBL17764156 | 0.82 | ITGA1 (0.48) | ITGA1CA1CA2ACLYTTR | |
| SCHEMBL17764157 | 0.78 | ITGA1 (0.49) | ITGA1CA1CA2ACLYAKR1C4 | |
| SCHEMBL9058121 | 0.75 | ITGA1 (0.49) | ITGA1ACLY | |
| SCHEMBL9057549 | 0.73 | PTGS2 (0.45) | CA1CA2PTGS2TTRPOLB | |
| SCHEMBL9056928 | 0.73 | MEN1 (0.54) | CA1CA2PTGS2TTRPOLB | |
| SCHEMBL5265908 | 0.73 | PTGS2 (0.59) | CA1CA2PTGS2TTRPOLB | |
| SCHEMBL11122023 | 0.73 | ITGA1 (0.78) | ITGA1CA1CA2ACLYTDP1 | |
| SCHEMBL9054334 | 0.73 | PTGS2 (0.51) | CA1CA2PTGS2TTRPOLB | |
| SCHEMBL9054225 | 0.72 | PTGS2 (0.59) | CA1CA2ACLYPTGS2TTR | |
| SCHEMBL9052519 | 0.71 | PTGS2 (0.50) | CA1CA2PTGS2TTRPOLB |
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 |