Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | SCN1A | P35498 | 3/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.52 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29016068 | 0.94 | TSHR (0.55) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL10884807 | 0.83 | TSHR (0.75) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL10888502 | 0.82 | TSHR (0.76) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL28570287 | 0.81 | SCN5A (0.51) | TDP1SCN1ASCN2ASCN3ACYP3A4 | |
| SCHEMBL10885624 | 0.81 | ALDH1A1 (0.77) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL3220487 | 0.81 | ALDH1A1 (0.77) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL10885774 | 0.81 | ALDH1A1 (0.77) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL10887297 | 0.81 | ALDH1A1 (0.77) | TSHRTDP1L3MBTL1SCN1ASCN2A | |
| SCHEMBL28562190 | 0.81 | SCN5A (0.50) | TDP1SCN1ASCN2ASCN3ACYP3A4 | |
| SCHEMBL28612893 | 0.81 | TSHR (0.58) | TSHRTDP1L3MBTL1CYP3A4MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112759531-B | Novel imine compound and preparation method thereof | 中国石油化工股份有限公司 | 2023-07-21 | — | — | CN | disclosed |
| CN-112759675-B | Catalyst component for preparing polyolefin, catalyst and application thereof | 中国石油化工股份有限公司 | 2023-05-02 | — | — | CN | disclosed |