Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9302445 | 1.00 | VNN1 (0.42) | VNN1TSHRALDH1A1IDO1CYP2C9 | |
| SCHEMBL7823614 | 0.82 | VNN1 (0.46) | VNN1IDO1CYP2C9NAMPTCYP1A2 | |
| SCHEMBL7823617 | 0.82 | VNN1 (0.46) | VNN1IDO1CYP2C9NAMPTCYP1A2 | |
| SCHEMBL3243595 | 0.78 | VNN1 (0.43) | VNN1IDO1CYP2C9NAMPTCYP1A2 | |
| SCHEMBL10762081 | 0.74 | ALDH1A1 (0.59) | TSHRALDH1A1CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL1233226 | 0.73 | TSHR (0.50) | TSHRALDH1A1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL9661857 | 0.73 | KCNA5 (0.44) | VNN1TSHRCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL9661853 | 0.73 | KCNA5 (0.44) | VNN1TSHRCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL8309619 | 0.69 | VNN1 (0.38) | VNN1TSHRALDH1A1IDO1CYP2C9 | |
| SCHEMBL6761465 | 0.68 | ALDH1A1 (0.52) | TSHRALDH1A1CYP1A2CYP2C19HIF1A |
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-5292749-A | Quinuclidine derivatives; bronchodilator agents, treatment of respiratory system disorders | PFIZER INC. (US) | 1994-03-08 | — | — | US | disclosed |