Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 6/20 | 0.32 |
| ▸ | RARA | P10276 | 2/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 2/20 | 0.32 |
| ▸ | CASP2 | P42575 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7959836 | 0.90 | CASP3 (0.34) | FABP4FABP5CASP3KDM4EALDH1A1 | |
| SCHEMBL7963652 | 0.90 | CASP3 (0.33) | FABP4FABP5CASP3KDM4EALDH1A1 | |
| SCHEMBL7964208 | 0.85 | RARG (0.36) | FABP4FABP5CASP3KDM4EALDH1A1 | |
| SCHEMBL7959787 | 0.84 | PTGS1 (0.36) | CASP3KDM4EALDH1A1GAAHPGD | |
| SCHEMBL8119171 | 0.80 | CASP3 (0.36) | CASP3KDM4EALDH1A1GAAHPGD | |
| SCHEMBL8132547 | 0.76 | CYP1A2 (0.34) | CASP3KDM4EALDH1A1GAAHPGD | |
| SCHEMBL7951484 | 0.75 | FABP4 (0.50) | FABP4FABP5KDM4EALDH1A1RARG | |
| SCHEMBL8128162 | 0.73 | CASP3 (0.34) | CASP3KDM4EALDH1A1GAAHPGD | |
| SCHEMBL8134794 | 0.71 | RARG (0.35) | CASP3KDM4EALDH1A1GAAHPGD | |
| SCHEMBL8167098 | 0.70 | GAA (0.34) | CASP3KDM4EALDH1A1GAAHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313305-B1 | ANTIBIOTICS, BACTERICIDES | HOECHST MARION ROUSSEL (FR) | 2001-11-06 | — | — | US | disclosed |
| US-5587372-A | BACERICIDES | ROUSSEL UCLAF (FR) | 1996-12-24 | — | — | US | disclosed |
| US-5455238-A | Bactericides | ROUSSEL UCLAF (FR) | 1995-10-03 | — | — | US | disclosed |