Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16288953 | 0.84 | PDGFRB (0.39) | PDE3BPDE3ANOS1ADORA3KDR | |
| SCHEMBL28169389 | 0.76 | DYRK1A (0.37) | SMN1; SMN2KDRMAP4K4CDK8CLK2 | |
| SCHEMBL21632275 | 0.76 | CYP1A2 (0.57) | NOS1PDGFRBPDGFRAALDH1A1BACE1 | |
| SCHEMBL16155308 | 0.76 | ALDH1A1 (0.50) | METPDE3BPDE3ALMNAALDH1A1 | |
| SCHEMBL4142083 | 0.76 | MET (0.38) | METPDE3BPDE3AKLKB1MAP4K1 | |
| SCHEMBL29975637 | 0.76 | CNR2 (0.43) | PDE3BPDE3ACNR2LMNAPDGFRB | |
| SCHEMBL31468230 | 0.76 | MALT1 (0.42) | NOS1LMNACYP2C9KDRNPC1 | |
| SCHEMBL1359776 | 0.76 | MAP4K4 (0.46) | PDE3BPDE3APDGFRBPDGFRAMAP4K4 | |
| SCHEMBL17442812 | 0.73 | KLKB1 (0.42) | KLKB1MAP4K1 | |
| SCHEMBL438735 | 0.72 | CYP1A2 (0.57) | SMN1; SMN2KDRNPC1PDGFRBPDGFRA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105968115-B | Quinolines, preparation method, intermediate, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2018-11-09 | — | — | CN | disclosed |
| CN-107312009-A | Quinolines, its preparation method, intermediate, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2017-11-03 | — | — | CN | disclosed |
| CN-107072985-A | Therapeutic inhibiting compound | 莱福斯希医药公司 | 2017-08-18 | — | — | CN | disclosed |
| CN-104109166-B | Quinoline compound, preparation method, intermediate, pharmaceutical composition and application thereof | 上海医药集团股份有限公司 | 2017-06-20 | — | — | CN | disclosed |
| CN-103080104-A | N-((6-amino-pyridin-3-yl)methyl)-heteroaryl-carboxamides as inhibitors of plasma kallikrein | NOVARTIS AG | 2013-05-01 | — | — | CN | disclosed |