Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 8/20 | 0.39 |
| ▸ | CNR1 | P21554 | 4/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.36 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21384575 | 0.90 | MCL1 (0.46) | MCL1KIF11CNR2CNR1IDH1 | |
| SCHEMBL21384560 | 0.85 | MCL1 (0.46) | MCL1KIF11CNR2CNR1IDH1 | |
| SCHEMBL21384576 | 0.71 | MRGPRX1 (0.63) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL21381357 | 0.71 | MAPT (0.48) | MCL1KIF11CHRNA7CA12CA1 | |
| SCHEMBL21394361 | 0.69 | MRGPRX1 (0.58) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL23877585 | 0.68 | MRGPRX1 (0.38) | MCL1MRGPRX1 | |
| SCHEMBL31046841 | 0.68 | MRGPRX1 (0.38) | MCL1MRGPRX1 | |
| SCHEMBL10826418 | 0.67 | KDM1A (0.62) | MCL1KIF11IDH1CA12CA1 | |
| SCHEMBL24268103 | 0.67 | MRGPRX1 (0.41) | MCL1MAPTDDR1MRGPRX1CCR2 | |
| SCHEMBL23877458 | 0.66 | KDM1A (0.38) | MRGPRX1 |
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-2019179436-A1 | ACID AMIDE COMPOUND AND USE THEREOF IN TREATMENT OF CANCERS | 成都海创药业有限公司 | 2019-09-26 | — | — | WO | disclosed |