Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31635695 | 0.87 | ALDH1A1 (0.55) | ALDH1A1HSD17B10POLBHTTLMNA | |
| SCHEMBL3987419 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HSD17B10POLBHTTLMNA | |
| Hydrochloric Acid SCHEMBL34467505 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HSD17B10POLBHTTLMNA | |
| SCHEMBL31635679 | 0.79 | ALDH1A1 (0.58) | ALDH1A1HSD17B10LMNACYP1A2HRH2 | |
| SCHEMBL16476545 | 0.76 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HTTLMNAHPGD | |
| SCHEMBL4015118 | 0.76 | ALDH1A1 (0.56) | ALDH1A1HSD17B10LMNAHPGDALOX12 | |
| SCHEMBL4107856 | 0.76 | ALDH1A1 (0.55) | ALDH1A1HSD17B10POLBLMNAHPGD | |
| SCHEMBL29442843 | 0.75 | ALDH1A1 (0.54) | ALDH1A1HSD17B10CYP1A2HRH2HRH1 | |
| SCHEMBL21384018 | 0.75 | ALDH1A1 (0.54) | ALDH1A1HSD17B10CYP1A2HRH2HRH1 | |
| SCHEMBL13845010 | 0.73 | ALDH1A1 (0.52) | ALDH1A1HSD17B10CYP1A2HRH2HRH1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009150196-A1 | N-THIAZOLYL-1, 2, 3, 4-TETRAHYDRO-6-ISOQUINOLINECARBOXAMIDE DERIVATIVES AS INHIBITORS OF STEAROYL COENZYME A DESATURASE | SMITHKLINE BEECHAM CORPORATION (US) | 2009-12-17 | — | — | WO | disclosed |
| WO-2009056556-A1 | SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |
| WO-2009056556-A1 | SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |