Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27691374 | 0.93 | KMT2A (0.38) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| Alcohol SCHEMBL28593573 | 0.90 | ALDH1A1 (0.43) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL9244723 | 0.79 | ALDH1A1 (0.36) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL28856650 | 0.71 | ALDH1A1 (0.33) | ALDH1A1NPSR1NR1H3 | |
| SCHEMBL3641299 | 0.71 | NPC1 (0.34) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL21160072 | 0.70 | KMT2A (0.42) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL28595008 | 0.68 | TDP1 (0.40) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL9505626 | 0.68 | TDP1 (0.40) | KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL28361228 | 0.67 | SMN1; SMN2 (0.59) | KMT2AMEN1SMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL10809865 | 0.67 | NPSR1 (0.50) | KMT2AMEN1ALDH1A1NPSR1L3MBTL1 |
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-116586094-A | Catalyst for synthesizing 2,2 '-bis (trifluoromethyl) -4,4' -diaminobiphenyl, preparation method and application thereof | 湖南贝泓新材料股份有限公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-116586079-A | Monoatomic cobalt catalyst, preparation method and application | 湖南贝泓新材料股份有限公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-113024385-B | Preparation method of 2,2 '-bis (trifluoromethyl) -4, 4' -diaminobiphenyl | 西安瑞联新材料股份有限公司 | 2022-08-16 | — | — | CN | disclosed |
| CN-113024385-A | Preparation method of 2,2 '-bis (trifluoromethyl) -4, 4' -diaminobiphenyl | 西安瑞联新材料股份有限公司 | 2021-06-25 | — | — | CN | disclosed |