Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TACR1 | P25103 | 1/20 | 0.49 |
| ▸ | TACR3 | P29371 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2362568 | 0.92 | ALDH1A1 (0.56) | ALDH1A1MAPTKMT2ATSHRACHE | |
| SCHEMBL40396 | 0.88 | CASR (0.51) | ALDH1A1MAPTKMT2ATSHRSMN1; SMN2 | |
| SCHEMBL21574177 | 0.87 | ALDH1A1 (0.51) | ALDH1A1MAPTKMT2ATSHRACHE | |
| SCHEMBL5147435 | 0.87 | HRH3 (0.60) | ALDH1A1KMT2AACHEHRH3 | |
| SCHEMBL16980628 | 0.85 | ALDH1A1 (0.57) | ALDH1A1MAPTKMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL12505784 | 0.84 | DRD4 (0.50) | ALDH1A1MAPTKMT2AKDM4ETACR1 | |
| SCHEMBL40051 | 0.84 | DRD4 (0.53) | ALDH1A1MAPTKMT2ATSHRLMNA | |
| SCHEMBL2249033 | 0.84 | HIF1A (0.50) | ALDH1A1MAPTKMT2AACHESMN1; SMN2 | |
| SCHEMBL24569593 | 0.83 | OPRD1 (0.50) | ACHEHRH3 | |
| SCHEMBL8161183 | 0.83 | ALDH1A1 (0.58) | ALDH1A1MAPTKMT2ATSHRKDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106999478-A | It is used as the Diarylurea derivatives of P38 kinase inhibitors | 瑞斯比维特有限公司 | 2017-08-01 | — | — | CN | claimed |
| CN-105073725-A | Pyrazolyl-ureas as kinase inhibitors | RESPIVERT LTD | 2015-11-18 | — | — | CN | claimed |
| CN-105658635-B | Thieno naphthenic base or thieno heterocycle analog derivative, preparation method and its application in medicine | 江苏恒瑞医药股份有限公司 | 2019-03-08 | — | — | CN | disclosed |
| CN-106999478-A | It is used as the Diarylurea derivatives of P38 kinase inhibitors | 瑞斯比维特有限公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-105073725-A | Pyrazolyl-ureas as kinase inhibitors | RESPIVERT LTD | 2015-11-18 | — | — | CN | disclosed |