Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 12/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.43 |
| ▸ | TSHR | P16473 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20422789 | 0.80 | ADORA3 (0.51) | PSMB8CYP1A2CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL8621948 | 0.80 | PSMB8 (0.49) | PSMB8CYP1A2CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL9866354 | 0.77 | MPL (0.40) | ALDH1A1MAPK1HIF1AMEN1KMT2A | |
| SCHEMBL9867795 | 0.76 | PSMB8 (0.42) | PSMB8CYP1A2CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL9866017 | 0.74 | PSMB8 (0.43) | PSMB8CYP1A2CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL9867577 | 0.74 | NPC1 (0.48) | CYP1A2CYP3A4CYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL9869261 | 0.74 | L3MBTL1 (0.43) | CYP1A2CYP3A4CYP2C19HSD17B10TSHR | |
| SCHEMBL9865831 | 0.73 | ALDH1A1 (0.46) | CYP1A2CYP3A4CYP2C19HSD17B10TSHR | |
| SCHEMBL7011881 | 0.69 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C19HSD17B10TSHR | |
| SCHEMBL2213825 | 0.69 | ADORA3 (0.59) | MAPK1MEN1KMT2ALMNATP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4985450-A | TREATMENT OF GLAUCOMA | AVENTIS PHARMACEUTICALS INC. | 1991-01-15 | — | — | US | disclosed |
| US-4873239-A | GLAUCOMA TREATMENT | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1989-10-10 | — | — | US | disclosed |
| US-4758578-A | Arylthiadiazolylsulfonamides, pharmaceutical compositions and use | HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) | 1988-07-19 | — | — | US | disclosed |