Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.33 |
| ▸ | TYR | P14679 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | MDM4 | O15151 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14051358 | 0.84 | TYR (0.46) | CNR2CYP3A4ATMNFE2L2TYR | |
| SCHEMBL8769118 | 0.78 | TP53 (0.50) | ALDH1A1TP53HDAC8TDP1TSHR | |
| SCHEMBL29756201 | 0.78 | ALDH1A1 (0.50) | TYRSMN1; SMN2ALDH1A1CA1CA2 | |
| SCHEMBL7935947 | 0.78 | CNR2 (0.42) | CNR2CYP3A4ATMNFE2L2TYR | |
| SCHEMBL11518269 | 0.78 | HDAC4 (0.51) | CNR2CYP3A4ATMTYRHPGD | |
| SCHEMBL10447240 | 0.77 | TAAR1 (0.50) | CNR2ATMHPGDSMN1; SMN2HDAC4 | |
| SCHEMBL8897527 | 0.76 | HDAC4 (0.37) | CYP3A4TYRHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL335942 | 0.76 | CNR2 (0.50) | CNR2CYP3A4ATMNFE2L2TYR | |
| SCHEMBL29033283 | 0.76 | CNR2 (0.50) | CNR2CYP3A4ATMNFE2L2TYR | |
| SCHEMBL335941 | 0.76 | CNR2 (0.50) | CNR2CYP3A4ATMNFE2L2TYR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019079578-A1 | BENZIMIDAZOLE DERIVATIVES AND THEIR USES | AMGEN INC. (US) | 2019-04-25 | — | — | WO | disclosed |