Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10659132 | 0.89 | HIF1A (0.41) | HIF1AKMT2AACLYPPARDNR1H4 | |
| SCHEMBL10655898 | 0.83 | KMT2A (0.38) | KMT2AACLYPPARDNR1H4GPBAR1 | |
| SCHEMBL10728658 | 0.83 | PLAU (0.36) | GPBAR1PTGS1ALOX5APFEN1 | |
| SCHEMBL4035353 | 0.82 | FFAR4 (0.44) | PPARDNR1H4GPBAR1KDM4EPTGDR2 | |
| SCHEMBL10734711 | 0.82 | PTGS1 (0.35) | GPBAR1PTGS1 | |
| SCHEMBL10658293 | 0.81 | PPARA (0.42) | PPARDGPBAR1PTGS1ALDH1A1GAA | |
| SCHEMBL11258956 | 0.80 | PTGDR2 (0.42) | PPARDNR1H4GPBAR1PTGDR2FFAR4 | |
| SCHEMBL10659627 | 0.80 | PTGS1 (0.41) | KMT2AGPBAR1KDM4EHTTPTGS1 | |
| SCHEMBL10655912 | 0.79 | KDM4E (0.45) | PPARDNR1H4KDM4EHTTPTGDR2 | |
| SCHEMBL10664107 | 0.79 | STK17B (0.40) | KMT2AGPBAR1KDM4EPTGS1CYP2C19 |
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-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | claimed |
| US-4728662-A | DIURETICS, URICOSURICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1988-03-01 | — | — | US | disclosed |
| US-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | disclosed |