Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7468941 | 0.84 | PDE4B (0.40) | ALDH1A1LMNATSHRHTTKMT2A | |
| SCHEMBL7466427 | 0.83 | APP (0.42) | ALDH1A1LMNAL3MBTL1GAAKDM4E | |
| SCHEMBL7471844 | 0.83 | ALDH1A1 (0.35) | CYP2A6ALDH1A1TSHRHTTKDM4E | |
| SCHEMBL7458288 | 0.78 | HSD11B1 (0.40) | HSD11B1TSHRL3MBTL1MAPT | |
| SCHEMBL7355495 | 0.77 | HPRT1 (0.38) | ALDH1A1LMNAL3MBTL1KMT2ANPC1 | |
| SCHEMBL7470694 | 0.76 | SQOR (0.40) | PTGS2ALDH1A1KMT2AMEN1PDE4B | |
| SCHEMBL10415463 | 0.75 | MAPT (0.41) | ALDH1A1LMNATSHRL3MBTL1HTT | |
| SCHEMBL7467257 | 0.75 | TOP1 (0.41) | MAPK14GAAKDM4ENPC1RAB9A | |
| SCHEMBL4439979 | 0.74 | ALDH1A1 (0.42) | ALDH1A1LMNAL3MBTL1GAAKDM4E | |
| SCHEMBL6991078 | 0.74 | SQOR (0.41) | CYP2A6ALDH1A1HTTPDE4BPDE4A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244617-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | Ortho-McNeil Pharmaceutical, Inc. (US) | 2002-10-02 | — | — | EP | claimed |
| WO-2001047875-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-07-05 | — | — | WO | claimed |