Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.58 |
| ▸ | MAOA | P21397 | 3/20 | 0.58 |
| ▸ | ESR1 | P03372 | 2/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21437943 | 0.82 | CHRM2 (0.51) | MAOBMAOANPC1RAB9AFFAR1 | |
| SCHEMBL23073036 | 0.76 | MAOB (0.63) | MAOBMAOAESR1ESR2NPC1 | |
| SCHEMBL23617314 | 0.76 | MAOB (0.58) | MAOBMAOAESR1ESR2NPC1 | |
| SCHEMBL26244636 | 0.75 | ESR1 (0.34) | ESR1ESR2ACHE | |
| SCHEMBL21455736 | 0.75 | MAOA (0.38) | MAOAESR1ESR2ADORA2AACHE | |
| SCHEMBL16938476 | 0.74 | MAOB (0.59) | MAOBMAOAESR1ESR2NPC1 | |
| SCHEMBL14266211 | 0.74 | MAOB (0.59) | MAOBMAOAESR1ESR2NPC1 | |
| SCHEMBL14266214 | 0.74 | MAOB (0.59) | MAOBMAOAESR1ESR2NPC1 | |
| SCHEMBL11732417 | 0.74 | MAOB (1.00) | MAOBMAOAESR1ESR2NPC1 | |
| SCHEMBL5401392 | 0.73 | FFAR1 (0.67) | MAOBESR1ESR2FFAR1 |
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-3687506-B1 | SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS | BIOCRYST PHARM INC (US) | 2021-07-07 | — | — | EP | disclosed |