Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | MLYCD | O95822 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1318756 | 0.86 | NR1H4 (0.55) | LMNAKMT2AKDM4EHPGDALDH1A1 | |
| SCHEMBL15428878 | 0.85 | ALDH1A1 (0.48) | LMNARAB9AMLYCDCYP1A2CYP2C19 | |
| SCHEMBL15428857 | 0.84 | CHRM3 (0.54) | CHRM3LMNARAB9APOLBHPGD | |
| SCHEMBL1319551 | 0.83 | POLB (0.66) | CHRM3LMNARAB9AMLYCDCYP1A2 | |
| SCHEMBL15428864 | 0.82 | MMP13 (0.65) | CHRM3LMNAGAAMEN1CYP3A4 | |
| SCHEMBL1317360 | 0.82 | MMP13 (0.74) | CYP1A2CYP2C19MMP13 | |
| SCHEMBL23447721 | 0.81 | MLYCD (0.77) | CHRM3LMNARAB9AMLYCDCYP1A2 | |
| SCHEMBL1222870 | 0.81 | SLC9A1 (0.67) | LMNACYP1A2CYP2C19GAAKMT2A | |
| SCHEMBL15428881 | 0.81 | PPARG (0.49) | LMNANR4A1NR4A2NR4A3MMP13 | |
| SCHEMBL15428855 | 0.81 | CHRM3 (0.57) | CHRM3NR4A1NR4A2NR4A3MMP13 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2346831-B1 | HETEROARYL DIAMIDE COMPOUNDS USEFUL AS MMP-13 INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2015-01-07 | — | — | EP | disclosed |
| US-8637550-B2 | Heteroaryl diamide compounds useful as MMP-13 inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-01-28 | — | — | US | disclosed |