Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | FABP3 | P05413 | 2/20 | 0.44 |
| ▸ | FABP4 | P15090 | 2/20 | 0.44 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.44 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.44 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | POLA1 | P09884 | 1/20 | 0.41 |
| ▸ | ANTXR2 | P58335 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA6 | P23280 | 2/20 | 0.40 |
| ▸ | CA5A | P35218 | 2/20 | 0.40 |
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 | 0.76 | PTGS2 (0.51) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL9052519 | 0.75 | PTGS2 (0.50) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL9061556 | 0.71 | PTGS2 (0.49) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL9055319 | 0.71 | MAPT (0.47) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL5265908 | 0.71 | PTGS2 (0.59) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL9054334 | 0.71 | PTGS2 (0.51) | PTGS2ENPP3ENPP1POLBPOLA1 | |
| SCHEMBL15524731 | 0.70 | CA1 (0.61) | PTGS2FABP3FABP4GABRA1GABRB2 | |
| SCHEMBL9052978 | 0.70 | PTGS2 (0.47) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL7937565 | 0.70 | PTGS2 (0.51) | PTGS2POLBPOLA1ANTXR2CA12 | |
| SCHEMBL9059958 | 0.70 | TPMT (0.47) | PTGS2POLBPOLA1ANTXR2CA12 |
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 |