Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSPO | P30536 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 8/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 8/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.33 |
| ▸ | HTR5A | P47898 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1026533 | 0.84 | HSD11B1 (0.33) | CRHBPCRHR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1026191 | 0.81 | MAOA (0.50) | CRHBPCRHR2KMT2AL3MBTL1ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL1026530 | 0.80 | ALDH1A1 (0.44) | L3MBTL1ALDH1A1SMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL1023947 | 0.79 | CTSC (0.38) | — | |
| SCHEMBL1026509 | 0.78 | CYP1A2 (0.36) | CRHBPCRHR2KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL1026880 | 0.78 | THRA (0.39) | CRHBPCRHR2KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL1025247 | 0.77 | CYP1A2 (0.50) | CRHBPCRHR2KMT2AALDH1A1SLC2A1 | |
| SCHEMBL1025248 | 0.77 | CYP1A2 (0.50) | CRHBPCRHR2KMT2AALDH1A1SLC2A1 | |
| SCHEMBL1026693 | 0.77 | ALDH1A1 (0.42) | KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL1027535 | 0.74 | MAOA (0.39) | KMT2AALDH1A1SMN1; SMN2GRM2GRM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2274288-A2 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | Incyte Corporation (US) | 2011-01-19 | — | — | EP | disclosed |