Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 3/20 | 0.48 |
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11705294 | 0.87 | SLC6A3 (0.40) | CYP11B1CYP11B2IDO1ALDH1A1MAPT | |
| SCHEMBL11703888 | 0.84 | IDO1 (0.44) | IDO1TDP1NR1I2NR3C1HTR1A | |
| SCHEMBL11703533 | 0.79 | CYP11B1 (0.62) | CYP11B1CYP11B2MAPT | |
| SCHEMBL11818545 | 0.77 | CYP11B1 (0.56) | CYP11B1CYP11B2IDO1NOS1NOS3 | |
| SCHEMBL11704145 | 0.74 | IDO1 (0.49) | CYP11B1CYP11B2IDO1NOS1NOS3 | |
| Hydrochloric Acid SCHEMBL28358964 | 0.73 | CYP3A4 (0.49) | CYP11B1CYP11B2IDO1PDE5AMAPT | |
| SCHEMBL11702709 | 0.73 | CYP19A1 (0.46) | CYP11B1CYP11B2 | |
| SCHEMBL28268232 | 0.70 | CYP11B1 (0.48) | CYP11B1CYP11B2PDE5AMAPTTDP1 | |
| SCHEMBL11703521 | 0.68 | CYP11B1 (0.65) | CYP11B1CYP11B2MAPT | |
| SCHEMBL11775786 | 0.68 | IDO1 (0.51) | CYP11B1CYP11B2IDO1PDE5AMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4006243-A | FUNGICIDE, BACTERICIDE, YEAST | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-02-01 | — | — | US | claimed |
| US-4006243-A | FUNGICIDE, BACTERICIDE, YEAST | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-02-01 | — | — | US | disclosed |