Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Dinitrophenylene SCHEMBL28072310 | 0.93 | L3MBTL1 (0.54) | CXCR3L3MBTL1CYP1A2CYP3A4TSHR | |
| SCHEMBL1053453 | 0.83 | KMT2A (0.60) | L3MBTL1CYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL9446995 | 0.82 | CYP1A2 (0.53) | CXCR3L3MBTL1CYP1A2CYP3A4TSHR | |
| SCHEMBL15081590 | 0.80 | L3MBTL1 (0.58) | L3MBTL1CYP1A2CYP3A4ALDH1A1MAPT | |
| SCHEMBL10918542 | 0.80 | TSHR (0.71) | CYP1A2TSHRALDH1A1MAPTCYP19A1 | |
| SCHEMBL5250015 | 0.79 | TSHR (0.65) | CYP1A2TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29864638 | 0.79 | TSHR (0.65) | CYP1A2TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL11714437 | 0.78 | L3MBTL1 (0.51) | CXCR3L3MBTL1CYP1A2CYP3A4TSHR | |
| SCHEMBL4603302 | 0.78 | CCNC (0.49) | CXCR3CYP1A2TSHRALDH1A1MAPT | |
| SCHEMBL9446990 | 0.78 | CYP2D6 (0.66) | CXCR3L3MBTL1CYP1A2CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021141165-A1 | AMINO ALCOHOL-BORON-BINOL COMPOSITE AND METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ALCOHOL DERIVATIVE USING SAME | (주)분자와물질 | 2021-07-15 | — | — | WO | disclosed |
| CN-108135871-A | Amine naphthoquinone compounds and pharmaceutical compositions for blocking ubiquitination-proteasome system of diseases | 台北医学大学 | 2018-06-08 | — | — | CN | disclosed |