Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.38 |
| ▸ | HTR2C | P28335 | 3/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | CCR9 | P51686 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 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 | |
|---|---|---|---|---|
| SCHEMBL28279003 | 0.91 | KLKB1 (0.53) | KLKB1KMT2AMCHR1HTR2CMAOB | |
| SCHEMBL17785263 | 0.87 | KLKB1 (0.63) | KLKB1KMT2A | |
| SCHEMBL31339410 | 0.87 | KLKB1 (0.63) | KLKB1KMT2A | |
| SCHEMBL19780571 | 0.84 | KLKB1 (0.47) | KLKB1KMT2AALDH1A1L3MBTL1CCR9 | |
| SCHEMBL28172178 | 0.83 | KLKB1 (0.46) | KLKB1MCHR1HTR2CMAOB | |
| SCHEMBL17785314 | 0.80 | KLKB1 (0.65) | KLKB1FAAH | |
| SCHEMBL3532926 | 0.77 | KMT2A (0.60) | KLKB1KMT2AALDH1A1L3MBTL1MEN1 | |
| SCHEMBL21081704 | 0.76 | KLKB1 (0.70) | KLKB1 | |
| SCHEMBL20531539 | 0.75 | KLKB1 (0.46) | KLKB1KMT2A | |
| SCHEMBL25205458 | 0.75 | KMT2A (0.55) | KMT2AALDH1A1L3MBTL1MEN1USP2 |
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-109311847-A | PYRAZOLE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS | 卡尔维斯塔制药有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-107108576-A | N- ((hetero) arylmethyl) -heteroaryl-carboxamide compounds as plasma kallikrein inhibitors | 卡尔维斯塔制药有限公司 | 2017-08-29 | — | — | CN | disclosed |