Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 20/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8706924 | 0.78 | SIGMAR1 (0.47) | SIGMAR1TP53TSHR | |
| SCHEMBL27434141 | 0.77 | ALDH1A1 (0.42) | TP53TSHR | |
| SCHEMBL8711508 | 0.76 | ALDH1A1 (0.46) | SIGMAR1TP53TSHR | |
| SCHEMBL11210194 | 0.75 | CRHBP (0.44) | SIGMAR1 | |
| SCHEMBL5556091 | 0.69 | SIGMAR1 (0.51) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL14491916 | 0.69 | SIGMAR1 (0.55) | SIGMAR1 | |
| SCHEMBL1529253 | 0.69 | SIGMAR1 (0.50) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL27693814 | 0.69 | F7 (0.43) | TSHR | |
| SCHEMBL27290812 | 0.68 | CA2 (0.39) | THPOMTOR | |
| SCHEMBL10947630 | 0.68 | SIGMAR1 (0.54) | SIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106834373-A | A kind of preparation method of L homophenylalanins or D homophenylalanins | 上海倍殊生物科技有限公司 | 2017-06-13 | — | — | CN | claimed |
| CN-104053772-A | Hydantoinase mutants | EVONIK INDUSTRIES AG | 2014-09-17 | — | — | CN | claimed |
| CN-106834373-A | A kind of preparation method of L homophenylalanins or D homophenylalanins | 上海倍殊生物科技有限公司 | 2017-06-13 | — | — | CN | disclosed |
| CN-104053772-A | Hydantoinase mutants | EVONIK INDUSTRIES AG | 2014-09-17 | — | — | CN | disclosed |