Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ECE1 | P42892 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14478789 | 0.75 | KDM4E (0.54) | RAB9ANPC1KDM4EMAPTGAA | |
| SCHEMBL12446486 | 0.75 | GFER (0.34) | RAB9AKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL24359598 | 0.75 | GAA (0.52) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL2608449 | 0.73 | ALDH1A1 (0.44) | RAB9AKDM4EMAPTSMN1; SMN2GAA | |
| SCHEMBL10175550 | 0.73 | RAB9A (0.41) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL16502279 | 0.72 | PDE10A (0.44) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL21143970 | 0.72 | RAB9A (0.45) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28913473 | 0.71 | RAB9A (0.59) | RAB9ANPC1KDM4EMAPTGAA | |
| SCHEMBL1574800 | 0.71 | HDAC1 (0.52) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28566906 | 0.68 | ADORA2A (0.33) | — |
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-108373476-B | Kinase inhibitor and preparation and application thereof | 成都地奥制药集团有限公司 | 2021-06-01 | — | — | CN | disclosed |