Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18926950 | 0.87 | SLC6A2 (0.36) | PTGS1PTGS2DRD3DRD2SLC6A2 | |
| SCHEMBL2734403 | 0.79 | NPC1 (0.37) | DRD3SLC6A2LMNACYP3A4SLC22A1 | |
| SCHEMBL3714616 | 0.78 | ALDH1A1 (0.39) | DRD3DRD2SLC6A2KDM4ECYP3A4 | |
| SCHEMBL10760096 | 0.78 | NPC1 (0.36) | KDM4ETSHRGAANOTUML3MBTL1 | |
| SCHEMBL9474995 | 0.77 | ALDH1A1 (0.36) | DRD3DRD2SLC6A2LMNACYP3A4 | |
| SCHEMBL34463863 | 0.75 | CHRM3 (0.35) | DRD3DRD2SLC6A2KDM4ELMNA | |
| SCHEMBL3373922 | 0.75 | MEN1 (0.35) | PTGS1DRD3DRD2SLC6A2KDM4E | |
| SCHEMBL9008263 | 0.75 | ALDH1A1 (0.42) | DRD3DRD2SLC6A2KDM4ELMNA | |
| SCHEMBL4055655 | 0.74 | MEN1 (0.35) | CHRM1NPC1MITFRAB9AMEN1 | |
| SCHEMBL2625761 | 0.74 | ALDH1A1 (0.33) | DRD3SLC6A2LMNACYP3A4SLC22A1 |
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-2034998-A1 | 1,2,3,4-TETRAHYDRO-QUINOLINE DERIVATIVES AS CETP INHIBITORS | Janssen Pharmaceutica, N.V. (BE) | 2009-03-18 | — | — | EP | disclosed |
| WO-2008079427-A1 | 1,2,3,4-TETRAHYDRO-QUINOLINE DERIVATIVES AS CETP INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-07-03 | — | — | WO | disclosed |