Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.39 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19794397 | 0.79 | NOTUM (0.55) | NOTUMALDH1A1MAPK1KDM4EEDNRB | |
| SCHEMBL16388509 | 0.78 | NR3C1 (0.42) | ESR2NR3C1ALDH1A1MAPK1KDM4E | |
| SCHEMBL16371342 | 0.77 | ADORA2A (0.43) | NOTUMALDH1A1MAPK1KDM4EEDNRB | |
| SCHEMBL21289803 | 0.76 | NOTUM (0.51) | NOTUMALDH1A1MAPK1KDM4EEDNRB | |
| SCHEMBL44890 | 0.75 | NOTUM (0.58) | NOTUMALDH1A1MAPK1KDM4EGRM5 | |
| SCHEMBL22030032 | 0.75 | NOTUM (0.50) | NOTUMALDH1A1MAPK1KDM4EEDNRB | |
| SCHEMBL514359 | 0.75 | NOTUM (0.62) | NOTUMALDH1A1MAPK1KDM4ECHRM1 | |
| SCHEMBL31410710 | 0.74 | ESR2 (0.76) | ESR2ALDH1A1MAPK1KDM4EPTPN5 | |
| SCHEMBL4341894 | 0.74 | NOTUM (0.78) | NOTUMALDH1A1MAPK1KDM4ECHRM1 | |
| SCHEMBL29563253 | 0.74 | NPC1 (0.51) | NOTUMALDH1A1MAPK1KDM4EGRM5 |
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-105517999-B | IDO inhibitors | 百时美施贵宝公司 | 2019-06-28 | — | — | CN | disclosed |