Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 6/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30464647 | 0.95 | KMT2A (0.40) | TSHRALDH1A1LMNATP53MAPK1 | |
| SCHEMBL28727222 | 0.95 | KMT2A (0.40) | TSHRALDH1A1LMNATP53MAPK1 | |
| SCHEMBL28727214 | 0.91 | MEN1 (0.37) | TSHRALDH1A1LMNATP53MAPK1 | |
| SCHEMBL12758251 | 0.89 | KDM4E (0.36) | TSHRALDH1A1LMNACHRM2CHRM4 | |
| SCHEMBL31575386 | 0.87 | ALDH1A1 (0.47) | ALDH1A1LMNACHRM2CHRM1CYP3A4 | |
| SCHEMBL24156033 | 0.85 | LMNA (0.44) | TSHRALDH1A1LMNACHRM2TP53 | |
| SCHEMBL14261086 | 0.85 | ALDH1A1 (0.38) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL12758193 | 0.84 | CHRM2 (0.39) | TSHRALDH1A1LMNACHRM2CHRM4 | |
| SCHEMBL10678505 | 0.84 | ALDH1A1 (0.42) | TSHRALDH1A1LMNACHRM2TP53 | |
| SCHEMBL13609911 | 0.84 | ALDH1A1 (0.42) | TSHRALDH1A1LMNACHRM2TP53 |
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-115260127-A | Preparation method of 5-pyrrolidinyl-2-phenylsulfonyl-2, 4-pentadienoic acid octyl ester | 常州佳德医药科技有限公司 | 2022-11-01 | — | — | CN | claimed |
| CN-115260127-A | Preparation method of 5-pyrrolidinyl-2-phenylsulfonyl-2, 4-pentadienoic acid octyl ester | 常州佳德医药科技有限公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-115260127-A | Preparation method of 5-pyrrolidinyl-2-phenylsulfonyl-2, 4-pentadienoic acid octyl ester | 常州佳德医药科技有限公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-115260127-A | Preparation method of 5-pyrrolidinyl-2-phenylsulfonyl-2, 4-pentadienoic acid octyl ester | 常州佳德医药科技有限公司 | 2022-11-01 | — | — | CN | disclosed |