Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLCG2 | P16885 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.56 |
| ▸ | DRD3 | P35462 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.54 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28082036 | 0.87 | NPC1 (0.64) | PLCG2NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL27908705 | 0.84 | DRD2 (0.54) | PLCG2KDM4ESMN1; SMN2ALDH1A1DRD2 | |
| SCHEMBL27891708 | 0.83 | KDM4E (0.64) | NPC1RAB9AKDM4EALDH1A1DRD2 | |
| SCHEMBL28082030 | 0.81 | MAPT (0.67) | NPC1RAB9AKDM4EALDH1A1HDAC3 | |
| SCHEMBL30102647 | 0.81 | NAMPT (0.63) | NPC1RAB9AKDM4EALDH1A1DRD2 | |
| SCHEMBL17209330 | 0.80 | CA12 (0.77) | NPC1RAB9AKDM4EALDH1A1DRD2 | |
| SCHEMBL6410116 | 0.77 | SMN1; SMN2 (0.72) | NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL27550290 | 0.77 | AKR1C3 (0.86) | KDM4EALDH1A1DRD2DRD3HSD17B10 | |
| SCHEMBL2304168 | 0.76 | PLCG2 (1.00) | PLCG2NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL6962971 | 0.76 | SMN1; SMN2 (0.89) | NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1 |
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-102153515-B | N,N'-bis-substituted urea Raf kinase inhibitors and preparation method and application thereof | UNIV CHINA PHARMA | 2013-02-27 | — | — | CN | disclosed |