Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL9651804 | 0.72 | NOTUM (0.36) | SETDB1ALDH1A1MAPTCA1CA2 | |
| SCHEMBL28980345 | 0.65 | DYRK1A (0.40) | KDM1ASETDB1ALDH1A1DYRK1AKDM4E | |
| Ciapilome SCHEMBL2110362 | 0.65 | ELANE (0.35) | NPC1RAB9AL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL28582333 | 0.64 | PARP15 (0.37) | CA1CA2PGR | |
| SCHEMBL1780017 | 0.63 | — | — | |
| SCHEMBL7041642 | 0.63 | — | — | |
| SCHEMBL5610745 | 0.62 | — | — | |
| SCHEMBL27367482 | 0.62 | TSHR (0.39) | ALDH1A1KDM4ECA2LOXL2 | |
| SCHEMBL24621213 | 0.62 | AKR1B1 (0.50) | L3MBTL1ALDH1A1KDM4EMAPTAR | |
| SCHEMBL31241488 | 0.62 | POLB (0.55) | L3MBTL1ALDH1A1KDM4EHPGDHSD17B10 |
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-103864661-A | Synthesis process of 2-amino-3-cyano pyrrole derivatives | Hunan huateng pharmaceutical co ltd | 2014-06-18 | — | — | CN | disclosed |