Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CCNK | O75909 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CCNH | P51946 | 1/20 | 0.37 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.37 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28038612 | 0.99 | KDM1A (0.42) | KDM1AKDM4ETAAR1CDK2AP1CHEK1 | |
| Hydrochloric Acid SCHEMBL28698584 | 0.99 | KDM1A (0.42) | KDM1AKDM4ETAAR1CDK2AP1CHEK1 | |
| SCHEMBL22255203 | 0.88 | KDM4E (0.44) | KDM4ETAAR1HRH3GRIN2B | |
| SCHEMBL10496394 | 0.85 | TAAR1 (0.57) | KDM1ATAAR1GRIN2B | |
| SCHEMBL14813680 | 0.85 | TAAR1 (0.57) | KDM1ATAAR1GRIN2B | |
| SCHEMBL4207773 | 0.81 | SOS1 (0.46) | KDM4ETAAR1HRH3GRIN2B | |
| SCHEMBL18677179 | 0.81 | TAAR1 (0.59) | KDM4ETAAR1HRH3GRIN2B | |
| SCHEMBL2466540 | 0.79 | GRIN2B (0.51) | KDM4ETAAR1HRH3GRIN2B | |
| SCHEMBL28215970 | 0.75 | GRIN2B (0.57) | KDM1ATAAR1GRIN2BKCNH2 | |
| SCHEMBL20273868 | 0.75 | KCNH2 (0.50) | KDM1AHRH3KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114835631-B | Preparation method of cis-1-benzyl-4-methyl-3-methylamino-piperidine dihydrochloride | 重庆恩联生物科技有限公司 | 2024-02-13 | — | — | CN | disclosed |
| CN-105906553-A | Synthesis method of N-benzyl-4-methylpiperidine-3-one hydrochloride | 重庆威尔德·浩瑞医药化工有限公司 | 2016-08-31 | — | — | CN | disclosed |