Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | MAOB | P27338 | 5/20 | 0.52 |
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30358086 | 0.84 | LOXL2 (0.61) | LOXL2MAOBMAOAKIF11LMNA | |
| SCHEMBL580840 | 0.84 | LOXL2 (0.61) | LOXL2MAOBMAOAKIF11LMNA | |
| Water SCHEMBL5709133 | 0.84 | LOXL2 (0.61) | LOXL2MAOBMAOAKIF11LMNA | |
| Benzylamine SCHEMBL11527820 | 0.84 | LOXL2 (0.67) | LOXL2TSHRMAOBMAOATAAR1 | |
| SCHEMBL297224 | 0.83 | LOXL2 (1.00) | LOXL2TSHRMAPTCYP2A6NSD2 | |
| Water SCHEMBL5709165 | 0.83 | LOXL2 (1.00) | LOXL2TSHRMAPTCYP2A6NSD2 | |
| Hydrochloric Acid SCHEMBL2326110 | 0.83 | LOXL2 (0.59) | LOXL2MAOBMAOAKIF11LMNA | |
| Bromide SCHEMBL6433668 | 0.83 | LOXL2 (0.59) | LOXL2MAOBMAOAKIF11LMNA | |
| Benzylamine SCHEMBL10738289 | 0.83 | LOXL2 (0.93) | LOXL2TSHRMAOBMAOATAAR1 | |
| Benzylamine SCHEMBL8645055 | 0.83 | LOXL2 (0.93) | LOXL2TSHRMAOBMAOATAAR1 |
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-102408285-A | Method for directly aminating benzyl hydrocarbon of methylbenzene derivative | UNIV NORTHEAST NORMAL | 2012-04-11 | — | — | CN | disclosed |
| CN-86100512-A | 2 of antitumor action is arranged, and 4-diamino-6-(N-methyl or formyl radical-replacement benzyl amino) quinoline derivatives is synthetic | — | 1987-09-02 | — | — | CN | disclosed |