Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.53 |
| ▸ | UBE2T | Q9NPD8 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | SMO | Q99835 | 1/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5009801 | 0.98 | RAB9A (0.55) | RAB9AL3MBTL1OPRM1OPRK1SMN1; SMN2 | |
| SCHEMBL21776925 | 0.87 | RAB9A (0.59) | RAB9AL3MBTL1SMN1; SMN2UBE2TKDM4E | |
| SCHEMBL1329870 | 0.86 | RAB9A (0.58) | RAB9AL3MBTL1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL30665072 | 0.86 | RAB9A (0.58) | RAB9AL3MBTL1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL6117108 | 0.86 | RAB9A (0.58) | RAB9AL3MBTL1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL30289763 | 0.85 | UBE2T (0.71) | OPRM1OPRK1SMN1; SMN2PARP1UBE2T | |
| SCHEMBL29475033 | 0.85 | UBE2T (0.71) | OPRM1OPRK1SMN1; SMN2PARP1UBE2T | |
| SCHEMBL19160081 | 0.84 | RAB9A (0.59) | RAB9AL3MBTL1SMN1; SMN2KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL5010433 | 0.84 | UBE2T (0.69) | OPRM1OPRK1SMN1; SMN2PARP1UBE2T | |
| SCHEMBL29074197 | 0.84 | UBE2T (0.69) | OPRM1OPRK1SMN1; SMN2PARP1UBE2T |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101437800-A | Compounds and compositions as HEDGEHOG pathway modulators | IRM LLC (BM) | 2009-05-20 | — | — | CN | claimed |
| WO-2018125961-A1 | POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS | MITOBRIDGE, INC. (US) | 2018-07-05 | — | — | WO | disclosed |
| CN-103736094-A | Methods and compositions for treating leukemia | NOVARTIS AG | 2014-04-23 | — | — | CN | disclosed |
| CN-102695547-A | Methods and compositions for treating leukemia | NOVARTIS AG | 2012-09-26 | — | — | CN | disclosed |
| WO-2009141386-A1 | DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS | NOVARTIS AG (CH) | 2009-11-26 | — | — | WO | disclosed |
| CN-101437800-A | Compounds and compositions as HEDGEHOG pathway modulators | IRM LLC (BM) | 2009-05-20 | — | — | CN | disclosed |
| EP-1308439-B1 | PROLINE DERIVATIVES AND USE THEREOF AS DRUGS | MITSUBISHI TANABE PHARMA CORP (JP) | 2008-10-15 | — | — | EP | disclosed |
| EP-1950199-A1 | Proline derivatives and use thereof as drugs | Mitsubishi Tanabe Pharma Corporation (JP) | 2008-07-30 | — | — | EP | disclosed |
| EP-1289982-A1 | BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APOB-100 SECRETION INHIBITORS | GLAXO GROUP LIMITED (GB) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001096327-A1 | BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APoB-100 SECRETION INHIBITORS | GLAXO GROUP LIMITED (GB) | 2001-12-20 | — | — | WO | disclosed |