Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL648679 | 0.82 | — | — | |
| SCHEMBL29789306 | 0.82 | — | — | |
| Formaldehyde SCHEMBL28184486 | 0.80 | HCAR2 (0.43) | HCAR2CYP11B1CYP11B2CHRNB4CHRNA3 | |
| Formic Acid Methyl Ester SCHEMBL28331389 | 0.79 | ATM (0.42) | HCAR2CYP17A1CYP11B1CYP11B2 | |
| Formic Acid Methyl Ester SCHEMBL28134488 | 0.78 | HCAR2 (0.36) | HCAR2 | |
| Formic Acid Methyl Ester SCHEMBL28317412 | 0.78 | KCNH2 (0.36) | HCAR2CHRNB2CHRNA4 | |
| Hydrazine SCHEMBL27843381 | 0.78 | HCAR2 (0.40) | HCAR2CYP17A1CYP11B1CYP11B2CHRNB4 | |
| Cyanide SCHEMBL28048152 | 0.76 | CYP11B1 (0.40) | HCAR2CYP17A1CYP11B1CYP11B2CHRNB4 | |
| SCHEMBL28206091 | 0.73 | HCAR2 (0.48) | HCAR2CYP17A1CYP11B1CYP11B2 | |
| Formic Acid Methyl Ester SCHEMBL29876092 | 0.72 | MEN1 (0.45) | — |
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-105745214-B | Tricyclic piperidine compounds | 埃科特莱茵药品有限公司 | 2019-02-19 | — | — | CN | disclosed |
| CN-107567449-A | Tricyclic piperidine compounds | 埃科特莱茵药品有限公司 | 2018-01-09 | — | — | CN | disclosed |
| CN-105745211-B | It is used as the tricyclic imidazole compound of the inhibitor of tryptophan hydroxylase | 埃科特莱茵药品有限公司 | 2017-09-26 | — | — | CN | disclosed |
| CN-105745211-A | Tricyclic imidazole compounds as inhibitors of tryptophan hydroxylase | 埃科特莱茵药品有限公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-105745214-A | Tricyclic piperidine compounds | 埃科特莱茵药品有限公司 | 2016-07-06 | — | — | CN | disclosed |