Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL437417 | 0.98 | NPSR1 (0.41) | ALDH1A1KMT2AMEN1GAANPSR1 | |
| SCHEMBL3239982 | 0.81 | NPSR1 (0.44) | ALDH1A1KMT2AMEN1NPSR1TSHR | |
| SCHEMBL587583 | 0.79 | HPGD (0.37) | ALDH1A1KMT2AMEN1GAANPSR1 | |
| SCHEMBL9442190 | 0.79 | GAA (0.42) | ALDH1A1KMT2AMEN1GAALMNA | |
| SCHEMBL9206408 | 0.78 | APP (0.38) | KMT2A | |
| SCHEMBL11173933 | 0.78 | GAA (0.43) | ALDH1A1KMT2AMEN1GAANPSR1 | |
| SCHEMBL6279274 | 0.78 | NPSR1 (0.35) | ALDH1A1KMT2AMEN1GAANPSR1 | |
| SCHEMBL3237294 | 0.78 | NPSR1 (0.41) | ALDH1A1KMT2AMEN1NPSR1MAPT | |
| SCHEMBL2866274 | 0.78 | NPSR1 (0.41) | ALDH1A1KMT2AMEN1NPSR1TSHR | |
| SCHEMBL27328134 | 0.78 | NPSR1 (0.41) | ALDH1A1KMT2AMEN1NPSR1MAPT |
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-109232535-A | A kind of preparation method of non-peptide batroxobin inhibitor dabigatran etcxilate | 重庆奥舍生物化工有限公司 | 2019-01-18 | — | — | CN | disclosed |
| CN-108864047-A | A kind of preparation method of non-peptide batroxobin inhibitor dabigatran etcxilate | 河南师范大学 | 2018-11-23 | — | — | CN | disclosed |