Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STK17B | O94768 | 1/20 | 0.40 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | GRK6 | P43250 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | BLVRB | P30043 | 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 | |
|---|---|---|---|---|
| SCHEMBL10660502 | 0.78 | PKM (0.45) | NPC1RAB9AFFAR1PKMMEN1 | |
| SCHEMBL10845047 | 0.77 | FFAR1 (0.37) | NPC1RAB9AFFAR1ESR1ESR2 | |
| SCHEMBL10847382 | 0.76 | NPC1 (0.35) | NPC1RAB9AESR1ESR2MAOA | |
| SCHEMBL10660005 | 0.76 | ESR1 (0.52) | NPC1RAB9AMEN1KMT2AESR1 | |
| SCHEMBL10737555 | 0.74 | STK17B (0.38) | STK17BRIPK2CYP2C9GRK6NPC1 | |
| SCHEMBL10663368 | 0.72 | MAPT (0.45) | NPC1RAB9A | |
| SCHEMBL10664107 | 0.71 | STK17B (0.40) | STK17BGRK6NPC1RAB9ACDC25B | |
| SCHEMBL10663535 | 0.71 | NPC1 (0.48) | NPC1RAB9ACYP1A2ESR1ESR2 | |
| SCHEMBL10661416 | 0.69 | ALDH1A1 (0.50) | MEN1KMT2AESR1ESR2 | |
| SCHEMBL10655912 | 0.69 | KDM4E (0.45) | FFAR1RXFP1 |
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-4602028-A | Antihypertensive 3-aryl-1,2-benzisoxazol-sulfonyl and sulfinylalkanoic acids | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1986-07-22 | — | — | US | disclosed |