Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.54 |
| ▸ | NCF1 | P14598 | 4/20 | 0.51 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.47 |
| ▸ | GUSB | P08236 | 2/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4273454 | 0.81 | NCF1 (0.52) | ADORA1ADORA2ANCF1TLR8GUSB | |
| SCHEMBL423902 | 0.81 | CYP1A2 (0.55) | NCF1TLR8GUSBELANEGAA | |
| SCHEMBL1810765 | 0.81 | SMN1; SMN2 (0.62) | ADORA2ALMNAKDM4EPOLBKMT2A | |
| SCHEMBL7805413 | 0.80 | NCF1 (0.76) | NCF1TLR8GUSBELANEALDH1A1 | |
| SCHEMBL7810731 | 0.80 | NCF1 (0.51) | ADORA1ADORA2ANCF1TLR8GUSB | |
| SCHEMBL31529344 | 0.79 | LMNA (0.69) | ADORA1ADORA2ATLR8LMNAKDM4E | |
| SCHEMBL28178173 | 0.79 | NCF1 (0.50) | ADORA1ADORA2ANCF1TLR8GUSB | |
| SCHEMBL21848421 | 0.78 | NCF1 (0.49) | ADORA1ADORA2ANCF1TLR8GUSB | |
| SCHEMBL31389285 | 0.76 | ALOX15 (0.70) | NCF1GUSBLMNAKDM4EKMT2A | |
| SCHEMBL18528819 | 0.76 | ALOX15 (0.70) | NCF1GUSBLMNAKDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-107438598-A | QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF | 米伦纽姆医药公司 | 2017-12-05 | — | — | CN | disclosed |