Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 3/20 | 0.32 |
| ▸ | CA9 | Q16790 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9196734 | 0.92 | VCAM1 (0.33) | VCAM1ALDH1A1ARCACNA1HMAPT | |
| SCHEMBL9198054 | 0.86 | CACNA1H (0.34) | ALDH1A1TDP1CA12CA9CACNA1H | |
| SCHEMBL11853546 | 0.72 | KDM4E (0.36) | ALDH1A1TDP1ARCA12CA9 | |
| SCHEMBL11641298 | 0.71 | ALDH1A1 (0.42) | ALDH1A1ARMAPTKDM4EHPGD | |
| SCHEMBL11822394 | 0.70 | CYP3A4 (0.40) | CYP3A4TSHRMAPK1TDP1AR | |
| SCHEMBL9204907 | 0.68 | CACNA1H (0.37) | ALDH1A1TSHRTDP1CACNA1HMAPT | |
| SCHEMBL8855505 | 0.67 | GRIN2D (0.47) | ALDH1A1CYP3A4TSHRTDP1MAPT | |
| SCHEMBL8855454 | 0.66 | ALDH1A1 (0.43) | ALDH1A1CYP3A4TDP1CACNA1HMAPT | |
| SCHEMBL11857184 | 0.66 | GRIN2D (0.43) | CACNA1HMAPTMEN1KMT2AKDM4E | |
| SCHEMBL11815894 | 0.65 | GRIN2D (0.38) | ALDH1A1CYP3A4TSHRMAPK1TDP1 |
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-0667862-A1 | 2-FLUOROALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1995-08-23 | — | — | EP | disclosed |