Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 2/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | EDNRB | P24530 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27461879 | 0.85 | CYP1A2 (0.56) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL8577077 | 0.77 | EDNRB (0.67) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL6314927 | 0.76 | EDNRB (0.79) | MAPK1EDNRBALDH1A1HPGDEDNRA | |
| SCHEMBL8798051 | 0.76 | EDNRB (0.57) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL8577921 | 0.76 | EDNRB (0.61) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL8653767 | 0.76 | EDNRB (0.52) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL8798547 | 0.75 | EDNRB (0.56) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL8804966 | 0.71 | EDNRB (0.58) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| SCHEMBL8577086 | 0.69 | TP53 (0.58) | MEN1KMT2AMAPK1HSD17B10CYP1A2 | |
| Graveolinine SCHEMBL25286396 | 0.69 | KDM4E (0.66) | MEN1KMT2AMAPK1HSD17B10CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5731321-A | Endothelin receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-03-24 | — | — | US | disclosed |