Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7184029 | 0.80 | ERCC5 (0.49) | CYP11B1CYP11B2LMNAHTTSMN1; SMN2 | |
| SCHEMBL4155873 | 0.79 | CYP2C19 (0.53) | OPRK1AKR1B1KLKB1POLBCA2 | |
| SCHEMBL28275207 | 0.76 | NAMPT (0.46) | CYP11B1CYP11B2LMNAHTTSMN1; SMN2 | |
| SCHEMBL20481563 | 0.75 | ALDH1A1 (0.51) | LMNASMN1; SMN2HPGDALDH1A1OPRM1 | |
| SCHEMBL9714504 | 0.75 | CYP11B1 (0.47) | CYP11B1CYP11B2SMN1; SMN2PTGS1PTGS2 | |
| SCHEMBL4553409 | 0.74 | AKR1B1 (0.41) | MEN1KMT2AAKR1B1POLBCA2 | |
| SCHEMBL3819996 | 0.74 | AKR1B1 (0.43) | ALDH1A1KMT2AAKR1B1POLBCA2 | |
| SCHEMBL28274090 | 0.72 | CTRB1 (0.51) | MEN1KMT2AKLKB1CA2 | |
| SCHEMBL27383724 | 0.72 | CYP11B1 (0.61) | CYP11B1CYP11B2LMNAHTTSMN1; SMN2 | |
| SCHEMBL3429972 | 0.71 | PLAU (0.44) | CYP11B1CYP11B2LMNAHTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103080104-B | N-((6-amino-pyridin-3-yl)methyl)-heteroaryl-carboxamides as inhibitors of plasma kallikrein | NOVARTIS AG | 2015-04-08 | — | — | CN | disclosed |