Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 9/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | AKT2 | P31751 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL23773002 | 1.00 | KLKB1 (0.43) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL23769261 | 0.92 | KLKB1 (0.44) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL21736739 | 0.88 | KLKB1 (0.46) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL23754165 | 0.87 | KLKB1 (0.47) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL29906650 | 0.87 | KLKB1 (0.47) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL23753986 | 0.86 | KLKB1 (0.45) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL23769158 | 0.86 | KLKB1 (0.45) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL31357725 | 0.86 | KLKB1 (0.45) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL23768889 | 0.86 | KLKB1 (0.45) | KLKB1NOTUMKDM4ENPC1RAB9A | |
| SCHEMBL23769179 | 0.86 | KLKB1 (0.48) | KLKB1NOTUMKDM4ENPC1RAB9A |
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-115087652-B | Heteroaromatic carboxamide derivatives as inhibitors of plasma kallikrein | 勃林格殷格翰国际有限公司 | 2024-05-07 | — | — | CN | disclosed |
| CN-115087652-A | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 勃林格殷格翰国际有限公司 | 2022-09-20 | — | — | CN | disclosed |