Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PRKCI | P41743 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | TYMP | P19971 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | TRPM2 | O94759 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8219871 | 0.79 | ALDH1A1 (0.54) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL8220603 | 0.78 | ALDH1A1 (0.53) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL8220691 | 0.77 | ALDH1A1 (0.49) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL8212270 | 0.77 | ALDH1A1 (0.49) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL8220600 | 0.74 | ALDH1A1 (0.45) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL8220809 | 0.70 | ALDH1A1 (0.50) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL21514162 | 0.68 | METAP2 (0.66) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL24087861 | 0.68 | CYP1A2 (0.57) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| Phthalazinone SCHEMBL51553 | 0.67 | PARP1 (1.00) | ALDH1A1HSD17B10PARP1PRKCIPDE4B | |
| SCHEMBL577268 | 0.67 | KDM4E (0.49) | ALDH1A1HSD17B10PARP1PRKCIPDE4B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008019303-A2 | PYRIDAZINONYL MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2008-02-14 | — | — | WO | disclosed |