Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PRCP | P42785 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL14857042 | 0.66 | SLC6A2 (0.47) | SLC6A3SLC6A4OPRM1OPRL1OPRD1 | |
| SCHEMBL1308581 | 0.65 | — | — | |
| SCHEMBL4446504 | 0.64 | MAOA (0.39) | SLC6A3SLC6A4OPRM1OPRL1OPRD1 | |
| SCHEMBL14856965 | 0.64 | SLC6A2 (0.50) | SLC6A3SLC6A4OPRM1OPRL1SLC6A2 | |
| SCHEMBL4438204 | 0.64 | CYP2A6 (0.34) | SLC6A3OPRM1OPRL1OPRD1OPRK1 | |
| SCHEMBL2795442 | 0.63 | ALDH1A1 (0.51) | OPRM1OPRL1KMT2AMEN1ALDH1A1 | |
| SCHEMBL5263610 | 0.62 | ALDH1A1 (0.47) | KMT2AALDH1A1LMNATP53HTT | |
| SCHEMBL3521022 | 0.62 | SLC6A3 (1.00) | SLC6A3SLC6A4SLC6A2KMT2AMEN1 | |
| SCHEMBL1309560 | 0.62 | OPRM1 (0.54) | SLC6A3SLC6A4OPRM1OPRL1OPRD1 | |
| SCHEMBL1310931 | 0.62 | OPRM1 (0.54) | SLC6A3SLC6A4OPRM1OPRL1OPRD1 |
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-2134692-A2 | QUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FOR SELECTIN INHIBITION | Wyeth a Corporation of the State of Delaware (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008121817-A2 | QUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FOR SELECTIN INHIBITION | WYETH (US) | 2008-10-09 | — | — | WO | disclosed |