Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | FSHR | P23945 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL14899276 | 1.00 | CYP2D6 (0.42) | CYP2D6HPGDSMN1; SMN2LMNAACHE | |
| SCHEMBL13625552 | 1.00 | CYP2D6 (0.42) | CYP2D6HPGDSMN1; SMN2LMNAACHE | |
| SCHEMBL8988318 | 0.97 | CYP2D6 (0.41) | CYP2D6HPGDSMN1; SMN2LMNAACHE | |
| SCHEMBL8988315 | 0.97 | CYP2D6 (0.41) | CYP2D6HPGDSMN1; SMN2LMNAACHE | |
| SCHEMBL8988311 | 0.97 | CYP2D6 (0.41) | CYP2D6HPGDSMN1; SMN2LMNAACHE | |
| SCHEMBL8988293 | 0.87 | EPHX2 (0.42) | CYP2D6HPGDSMN1; SMN2LMNAACHE | |
| SCHEMBL14899279 | 0.87 | HIF1A (0.39) | CYP2D6HPGDACHESMPD3MEN1 | |
| SCHEMBL8988202 | 0.87 | FSHR (0.44) | HPGDSMN1; SMN2ACHEMEN1KMT2A | |
| SCHEMBL2392497 | 0.87 | FSHR (0.44) | HPGDSMN1; SMN2ACHEMEN1KMT2A | |
| SCHEMBL2389637 | 0.87 | FSHR (0.44) | HPGDSMN1; SMN2ACHEMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8431702-B2 | Therapeutically useful substituted hydropyrido [3,2,1-ij] quinoline compounds | ALLERGAN, INC. (US) | 2013-04-30 | — | — | US | disclosed |
| WO-2009137681-A1 | THERAPEUTICALLY USEFUL SUBSTITUTED HYDROPYRIDO [3,2,1-IJ] QUINOLINE COMPOUNDS | ALLERGAN, INC. (US) | 2009-11-12 | — | — | WO | disclosed |