Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.38 |
| ▸ | PRKCG | P05129 | 2/20 | 0.38 |
| ▸ | PRKCB | P05771 | 2/20 | 0.38 |
| ▸ | PRKCA | P17252 | 2/20 | 0.38 |
| ▸ | PRKACA | P17612 | 2/20 | 0.38 |
| ▸ | PRKACG | P22612 | 2/20 | 0.38 |
| ▸ | PRKACB | P22694 | 2/20 | 0.38 |
| ▸ | PRKCH | P24723 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290433 | 0.88 | KDM4E (0.55) | KDM4EPOLBHIF1AEPAS1HRH3 | |
| Tert-Butyl Formate SCHEMBL27994114 | 0.87 | CYP2C19 (0.43) | CYP2C19 | |
| Tert-Butyl Formate SCHEMBL27844848 | 0.82 | CHRNB2 (0.52) | KDM4EALDH1A1CHRNB2CHRNA4KMT2A | |
| SCHEMBL27930152 | 0.78 | CHRNB2 (0.46) | KDM4EPOLBSMN1; SMN2ALDH1A1CHRNB2 | |
| Tert-Butyl Formate SCHEMBL28289070 | 0.77 | CHRM2 (0.38) | KDM4EALDH1A1CHRM2CHRM1CHRM3 | |
| Tert-Butyl Formate SCHEMBL28055329 | 0.75 | TDP1 (0.38) | — | |
| Tert-Butyl Formate SCHEMBL28055330 | 0.75 | TDP1 (0.38) | — | |
| Pyridine SCHEMBL28167226 | 0.74 | TP53 (0.44) | KDM4EPOLBTP53CYP2C19 | |
| Tert-Butyl Formate SCHEMBL28275510 | 0.74 | TDP1 (0.37) | — | |
| Tert-Butyl Formate SCHEMBL28058842 | 0.73 | TDP1 (0.36) | — |
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-109563092-A | It can be used as the 2- phenylimidazole of the active inhibitor of mammal tyrosine kinase ROR1 simultaneously [4,5-B] pyridine -7- amine derivative | 坎塞拉有限公司 | 2019-04-02 | — | — | CN | disclosed |