Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19520662 | 0.81 | MAPK1 (0.41) | KDM4E | |
| SCHEMBL26041476 | 0.72 | KDM4E (0.40) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL24346570 | 0.72 | KDM4E (0.40) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL24346569 | 0.72 | KDM4E (0.40) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL26041506 | 0.72 | KDM4E (0.40) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL27347400 | 0.70 | ALDH1A1 (0.36) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL4044008 | 0.67 | MAPKAPK2 (0.43) | ALDH1A1BRD4KMT2AMAPKAPK2CHRNB2 | |
| SCHEMBL2784766 | 0.66 | BRD4 (0.44) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL3072002 | 0.65 | KMT2A (0.43) | ALDH1A1BRD4KMT2AMMP2ANPEP | |
| SCHEMBL3072000 | 0.65 | KMT2A (0.43) | ALDH1A1BRD4KMT2AMMP2ANPEP |
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-2021026047-A1 | HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2021-02-11 | — | — | WO | disclosed |