Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21764828 | 0.77 | IGF1R (0.34) | ALDH1A1HPGDGAAADORA1IGF1R | |
| SCHEMBL22054063 | 0.76 | ADORA1 (0.33) | ALDH1A1KDM4EHSD17B10HPGDGAA | |
| SCHEMBL16006803 | 0.73 | TRPM2 (0.47) | ALDH1A1LMNAPLA2G7KDM4EMAPK1 | |
| SCHEMBL21752547 | 0.71 | TRPM2 (0.45) | ALDH1A1LMNAPLA2G7KDM4EHPGD | |
| SCHEMBL17024846 | 0.69 | TRPM2 (0.39) | ALDH1A1LMNAPLA2G7KDM4EMAPK1 | |
| SCHEMBL14487509 | 0.65 | PLA2G7 (0.41) | ALDH1A1LMNAPLA2G7KDM4EMAPK1 | |
| SCHEMBL14487942 | 0.65 | TRPM2 (0.44) | ALDH1A1LMNAPLA2G7HSD17B10GAA | |
| SCHEMBL21296716 | 0.64 | MAPK1 (0.46) | ALDH1A1MAPK1HPGDGAAALOX15 | |
| SCHEMBL15033505 | 0.64 | LMNA (0.97) | ALDH1A1LMNAKDM4EMAPK1HSD17B10 | |
| SCHEMBL21995928 | 0.64 | BRD4 (0.39) | ALDH1A1LMNAPLA2G7KDM4EHSD17B10 |
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-2020041100-A1 | NOVEL ARYLOXYPIPERIDINE PYRAZOLE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2020-02-27 | — | — | WO | disclosed |