Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.39 |
| ▸ | CHUK | O15111 | 2/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | SETD2 | Q9BYW2 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CCNC | P24863 | 2/20 | 0.37 |
| ▸ | CDK8 | P49336 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | CFD | P00746 | 2/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL28064535 | 0.85 | HPGD (0.46) | IKBKBCHUKNSD2PARP1CCNC | |
| SCHEMBL30494484 | 0.85 | HPGD (0.46) | IKBKBCHUKNSD2PARP1CCNC | |
| SCHEMBL24074547 | 0.84 | GRM2 (0.44) | IKBKBCHUKCCNCCDK8MEN1 | |
| SCHEMBL28064557 | 0.81 | HDAC11 (0.47) | IKBKBPARP1CCNCCDK8 | |
| SCHEMBL28828024 | 0.78 | AURKA (0.42) | KMT2A | |
| SCHEMBL30494403 | 0.74 | HSD17B10 (0.58) | NSD2MEN1USP2ALDH1A1HPGD | |
| SCHEMBL29053644 | 0.74 | HSD17B10 (0.58) | NSD2MEN1USP2ALDH1A1HPGD | |
| SCHEMBL29053569 | 0.73 | HSD17B10 (0.61) | NSD2MEN1USP2ALDH1A1HPGD | |
| SCHEMBL28064616 | 0.72 | HRH4 (0.40) | PARP1MEN1USP2ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL27899621 | 0.72 | HSD17B10 (0.59) | NSD2MEN1USP2ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-105555763-A | Indole-carboxamide derivatives | HOFFMANN LA ROCHE | 2016-05-04 | — | — | CN | claimed |
| CN-105555763-A | Indole-carboxamide derivatives | HOFFMANN LA ROCHE | 2016-05-04 | — | — | CN | disclosed |