Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.37 |
| ▸ | NUDT1 | P36639 | 5/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CTRC | Q99895 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5248954 | 0.85 | GRIA1 (0.41) | BCHEGRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL21443855 | 0.80 | GRIA1 (0.36) | BCHEGRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL4366358 | 0.76 | PARP1 (0.42) | BCHEGRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL14785203 | 0.76 | PARP10 (0.51) | BCHEGRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL5335092 | 0.75 | NOTUM (0.40) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL29627844 | 0.75 | NOTUM (0.40) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL1632063 | 0.75 | PNMT (0.42) | BCHEGRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL3453685 | 0.74 | ALDH1A1 (0.43) | BCHEMEN1LMNATHRBBLM | |
| SCHEMBL3453076 | 0.74 | BCL2L1 (0.43) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL4213135 | 0.74 | KDM1A (0.47) | BCHEGRIA1GRIA2GRIA3GRIA4 |
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 |