Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6258947 | 0.87 | SIGMAR1 (0.65) | SIGMAR1NPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL28192755 | 0.85 | CYP2A6 (0.41) | SIGMAR1NPC1RAB9ACYP11B2ALDH1A1 | |
| SCHEMBL28192152 | 0.84 | SIGMAR1 (0.58) | SIGMAR1NPC1RAB9ACYP11B2ALDH1A1 | |
| SCHEMBL28324685 | 0.77 | SIGMAR1 (0.53) | SIGMAR1NPC1RAB9AALDH1A1KMT2A | |
| SCHEMBL28324632 | 0.77 | SIGMAR1 (0.53) | SIGMAR1NPC1RAB9AL3MBTL1MEN1 | |
| SCHEMBL28561721 | 0.77 | SIGMAR1 (0.56) | SIGMAR1NPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL28192155 | 0.77 | SIGMAR1 (0.56) | SIGMAR1NPC1RAB9AALDH1A1KMT2A | |
| SCHEMBL28192173 | 0.77 | SIGMAR1 (0.56) | SIGMAR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28854194 | 0.77 | SIGMAR1 (0.52) | SIGMAR1NPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL6040419 | 0.72 | SIGMAR1 (0.54) | SIGMAR1NPC1RAB9AHPGDSMN1; SMN2 |
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-107417628-A | Diaryl quianzolinones, its preparation method and its medical usage and the pharmaceutical composition comprising such compound | 中国人民解放军军事医学科学院毒物药物研究所 | 2017-12-01 | — | — | CN | claimed |
| CN-107417628-A | Diaryl quianzolinones, its preparation method and its medical usage and the pharmaceutical composition comprising such compound | 中国人民解放军军事医学科学院毒物药物研究所 | 2017-12-01 | — | — | CN | disclosed |