Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.32 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4544262 | 1.00 | HPGD (0.43) | HPGDSMN1; SMN2TRPV1ALDH1A1DRD2 | |
| SCHEMBL4271068 | 0.90 | HPGD (0.48) | HPGDSMN1; SMN2TRPV1ALDH1A1KMT2A | |
| SCHEMBL4271070 | 0.90 | HPGD (0.48) | HPGDSMN1; SMN2TRPV1ALDH1A1KMT2A | |
| SCHEMBL29359309 | 0.90 | HPGD (0.48) | HPGDSMN1; SMN2TRPV1ALDH1A1KMT2A | |
| SCHEMBL4273124 | 0.72 | EGFR (0.58) | DRD2DRD3KMT2A | |
| SCHEMBL4265928 | 0.72 | EGFR (0.58) | DRD2DRD3KMT2A | |
| SCHEMBL4268501 | 0.71 | GPR183 (0.49) | HPGDSMN1; SMN2ALDH1A1KMT2ANPC1 | |
| SCHEMBL4266223 | 0.71 | TRPV1 (0.51) | HPGDSMN1; SMN2TRPV1ALDH1A1KMT2A | |
| SCHEMBL4266221 | 0.71 | TRPV1 (0.51) | HPGDSMN1; SMN2TRPV1ALDH1A1KMT2A | |
| SCHEMBL4266852 | 0.70 | TRPM8 (0.36) | KMT2ANPC1MEN1PTGS2 |
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-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | disclosed |