Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC8 | Q09428 | 1/20 | 0.51 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | TXNRD1 | Q16881 | 2/20 | 0.47 |
| ▸ | TXNRD3 | Q86VQ6 | 2/20 | 0.47 |
| ▸ | TXNRD2 | Q9NNW7 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.45 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.45 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL4136990 | 0.87 | KIF11 (0.51) | ABCC8KCNJ11ALDH1A1HIF1AKIF11 | |
| SCHEMBL29269101 | 0.81 | TDP1 (0.50) | ALDH1A1HIF1ATDP1HPGDTSHR | |
| SCHEMBL15868446 | 0.81 | ALDH1A1 (0.58) | ALDH1A1HIF1ATDP1HPGDTSHR | |
| SCHEMBL5958796 | 0.77 | TDP1 (0.65) | ABCC8KCNJ11ALDH1A1HIF1ATDP1 | |
| SCHEMBL8147133 | 0.76 | ALDH1A1 (0.58) | ABCC8KCNJ11ALDH1A1HIF1ATDP1 | |
| SCHEMBL2137404 | 0.75 | ALDH1A1 (0.63) | ALDH1A1HIF1ATDP1HPGDTSHR | |
| SCHEMBL3207733 | 0.74 | AR (0.53) | ABCC8KCNJ11ALDH1A1TDP1CYP3A4 | |
| SCHEMBL30600332 | 0.74 | CYP19A1 (0.64) | ALDH1A1HIF1ATDP1HPGDTSHR | |
| SCHEMBL13917955 | 0.74 | TSHR (0.52) | ALDH1A1TSHRSMN1; SMN2KIF11MAPT | |
| Water SCHEMBL27408458 | 0.73 | ALDH1A1 (0.61) | ALDH1A1HIF1ATDP1HPGDTSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112500297-B | Bis-trifluoromethyl-benzene-substituted asymmetric meta-aromatic diamine monomer and preparation method thereof | 常州大学 | 2022-09-23 | — | — | CN | disclosed |