Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 5/20 | 0.35 |
| ▸ | CA2 | P00918 | 5/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL20424215 | 1.00 | KMT2A (0.43) | KMT2ARAB9ADGAT1CA1CA2 | |
| SCHEMBL20398734 | 1.00 | KMT2A (0.43) | KMT2ARAB9ADGAT1CA1CA2 | |
| SCHEMBL22503762 | 1.00 | KMT2A (0.43) | KMT2ARAB9ADGAT1CA1CA2 | |
| SCHEMBL20442243 | 1.00 | KMT2A (0.43) | KMT2ARAB9ADGAT1CA1CA2 | |
| SCHEMBL20444259 | 0.86 | CA1 (0.35) | KMT2ACA1CA2CA9CA12 | |
| SCHEMBL21880804 | 0.86 | CA1 (0.35) | KMT2ACA1CA2CA9CA12 | |
| SCHEMBL20424253 | 0.86 | CA1 (0.35) | KMT2ACA1CA2CA9CA12 | |
| SCHEMBL20398753 | 0.84 | CA1 (0.39) | KMT2ACA1CA2CA9CA12 | |
| SCHEMBL28997382 | 0.84 | CA1 (0.39) | KMT2ACA1CA2CA9CA12 | |
| SCHEMBL20398721 | 0.84 | CA1 (0.39) | KMT2ACA1CA2CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110214135-B | Indanyl amino pyrazinyl cyclopropane carboxylic acid, pharmaceutical composition and application thereof | 勃林格殷格翰国际有限公司 | 2023-02-21 | — | — | CN | disclosed |