Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 5/20 | 0.35 |
| ▸ | ACHE | P22303 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.35 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | FABP1 | P07148 | 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 | |
|---|---|---|---|---|
| SCHEMBL550024 | 0.98 | BCHE (0.37) | BCHEACHEALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL16766410 | 0.96 | BCHE (0.35) | BCHEACHEALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL9986878 | 0.88 | HSD17B10 (0.37) | ACHEALDH1A1HSD17B10CYP1A2KDM4E | |
| SCHEMBL29372877 | 0.67 | TRPM4 (0.52) | BCHEACHEALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL13726631 | 0.67 | ALDH1A1 (0.41) | BCHEACHEALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL29853815 | 0.65 | KIF11 (0.49) | ALDH1A1HSD17B10CYP1A2KDM4ETSHR | |
| SCHEMBL322439 | 0.65 | KIF11 (0.49) | ALDH1A1HSD17B10CYP1A2KDM4ETSHR | |
| SCHEMBL8304317 | 0.65 | NQO1 (0.31) | ALDH1A1HSD17B10KDM4E | |
| SCHEMBL2412691 | 0.65 | ALDH1A1 (0.43) | ALDH1A1HSD17B10CYP1A2KDM4ETSHR | |
| SCHEMBL814299 | 0.64 | BCL2L1 (0.31) | TSHR |
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-2010005528-A2 | PYRROLOPYRIDINE CARBOXYLIC ACID DERIVATIVES | IRONWOOD PHARMACEUTICALS INCORPORATED (US) | 2010-01-14 | — | — | WO | disclosed |