Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.32 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL434429 | 0.78 | LMNA (0.42) | LMNAAKR1B1GABRA5GABRB2HSD17B10 | |
| SCHEMBL1321921 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL25267909 | 0.68 | ALDH1A1 (0.37) | LMNAAKR1B1GABRA5GABRB2HSD17B10 | |
| SCHEMBL5989046 | 0.68 | HCAR2 (0.37) | LMNAAKR1B1GABRA5GABRB2HSD17B10 | |
| SCHEMBL877436 | 0.67 | HCAR2 (0.52) | GABRA5GABRB2ALDH1A1CYP3A4GABRA1 | |
| SCHEMBL1592992 | 0.67 | GABRA5 (0.43) | LMNAAKR1B1GABRA5GABRB2HSD17B10 | |
| Bromide SCHEMBL7819075 | 0.67 | AKR1B1 (0.35) | LMNAAKR1B1GABRA5GABRB2HSD17B10 | |
| Hydrochloric Acid SCHEMBL1371875 | 0.65 | HCAR2 (0.50) | GABRA5GABRB2ALDH1A1CYP3A4GABRA1 | |
| SCHEMBL5513007 | 0.63 | HCAR2 (0.56) | — | |
| SCHEMBL14387809 | 0.63 | THRB (0.43) | LMNAHSD17B10ALDH1A1GABRR1HPGD |
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-2430013-A1 | HETEROARYL COMPOUNDS AS PIKK INHIBITORS | Amgen, Inc (US) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010132598-A1 | HETEROARYL COMPOUNDS AS PIKK INHIBITORS | AMGEN INC. (US) | 2010-11-18 | — | — | WO | disclosed |