Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | CLK1 | P49759 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21613456 | 0.87 | PDGFRB (0.40) | PDGFRBPDGFRAMAP4K4FYN | |
| SCHEMBL21613445 | 0.86 | PSMB5 (0.45) | PDGFRBPDGFRAKDM4ENPC1ALDH1A1 | |
| SCHEMBL21613471 | 0.82 | GRIN2B (0.43) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL21613461 | 0.82 | MAP4K4 (0.43) | RAB9AMAP4K4PSMB5EGLN1METAP2 | |
| SCHEMBL21613616 | 0.81 | CYP2A6 (0.40) | CYP3A4 | |
| SCHEMBL21613450 | 0.81 | PDGFRB (0.43) | PDGFRBPDGFRA | |
| SCHEMBL21613574 | 0.81 | KMO (0.37) | PDGFRBPDGFRAKDM4ENPC1ALDH1A1 | |
| SCHEMBL21613591 | 0.78 | GRIN2B (0.35) | — | |
| SCHEMBL21613600 | 0.78 | PDGFRB (0.50) | PDGFRBPDGFRA | |
| SCHEMBL7235627 | 0.77 | NOS2 (0.45) | CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3319963-B1 | SUBSTITUTED 4-AZAINDOLES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-01-08 | — | — | EP | disclosed |