Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.48 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.48 |
| ▸ | GABRP | O00591 | 1/20 | 0.48 |
| ▸ | GABRD | O14764 | 1/20 | 0.48 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.48 |
| ▸ | GABRE | P78334 | 1/20 | 0.48 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.48 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.48 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.48 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1808276 | 0.88 | GABRP (0.45) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL1808049 | 0.81 | GABRP (0.40) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL1808275 | 0.81 | GABRP (0.42) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL18905803 | 0.79 | GABRP (0.41) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL18905816 | 0.79 | GABRP (0.41) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL1809309 | 0.77 | KDM4E (0.40) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL18905808 | 0.76 | GABRP (0.39) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL1808048 | 0.75 | GABRP (0.38) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL1808127 | 0.73 | HPGD (0.44) | ALDH1A1KDM4EMAPK1MAPTHPGD | |
| SCHEMBL2824300 | 0.71 | LMNA (0.45) | ALDH1A1L3MBTL1KDM4EMAPK1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011056725-A1 | PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2011-05-12 | — | — | WO | disclosed |
| WO-2011056725-A1 | PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2011-05-12 | — | — | WO | disclosed |