Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA4 | P22748 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | POLA1 | P09884 | 1/20 | 0.42 |
| ▸ | ANTXR2 | P58335 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 2/20 | 0.41 |
| ▸ | CA6 | P23280 | 2/20 | 0.41 |
| ▸ | CA5A | P35218 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9052969 | 0.88 | CA1 (0.48) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL9054334 | 0.86 | PTGS2 (0.51) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL9052978 | 0.85 | PTGS2 (0.47) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL9054965 | 0.84 | PTGS2 (0.48) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL9056474 | 0.80 | TP53 (0.49) | CA1CA2ALDH1A1POLBLMNA | |
| SCHEMBL9056482 | 0.80 | TP53 (0.49) | CA1CA2ALDH1A1POLBLMNA | |
| SCHEMBL9057549 | 0.77 | PTGS2 (0.45) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL7937565 | 0.77 | PTGS2 (0.51) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL9053538 | 0.74 | PTGS2 (0.44) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL9055309 | 0.74 | KMT2A (0.48) | PTGS2CA1CA2CA9CA12 |
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 |