Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.70 |
| ▸ | NPC1 | O15118 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.51 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.51 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30080257 | 0.98 | RAB9A (0.73) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL28469392 | 0.98 | RAB9A (0.73) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL19155146 | 0.94 | NPC1 (0.60) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL27647724 | 0.84 | ALDH1A1 (0.58) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL13162659 | 0.84 | NPC1 (0.97) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL17786073 | 0.83 | ALDH1A1 (0.69) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL8198182 | 0.83 | NPC1 (1.00) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL17786092 | 0.82 | ALDH1A1 (0.72) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL22688916 | 0.81 | ALDH1A1 (0.54) | RAB9ANPC1ALDH1A1LMNAHPGD | |
| SCHEMBL13162641 | 0.81 | NPC1 (0.90) | RAB9ANPC1ALDH1A1LMNAHPGD |
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-110041272-B | 2- (2-chlorphenyl) quinazoline-4 (3H) -ketone derivative and preparation method and application thereof | 中国人民解放军军事科学院军事医学研究院 | 2020-10-30 | — | — | CN | disclosed |
| CN-110041272-A | 2- (2- chlorphenyl) quinazoline -4 (3H) -one analog derivative and its preparation method and application | 中国人民解放军军事科学院军事医学研究院 | 2019-07-23 | — | — | CN | disclosed |