Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 2/20 | 0.37 |
| ▸ | DHPS | P49366 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL17577600 | 0.84 | KDM4E (0.40) | PARP1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL9394351 | 0.80 | PARP1 (0.61) | PARP1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL12702816 | 0.77 | PARP1 (0.67) | PARP1GRM2 | |
| SCHEMBL17577713 | 0.77 | KDM4E (0.56) | KDM4EALDH1A1TDP1SMN1; SMN2 | |
| SCHEMBL1896689 | 0.77 | PARP1 (0.71) | PARP1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL3576491 | 0.77 | PARP1 (0.58) | PARP1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL1590065 | 0.76 | PARP1 (0.65) | PARP1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL4147543 | 0.74 | PARP1 (0.62) | PARP1KDM4EALDH1A1NSD2DHPS | |
| SCHEMBL3753520 | 0.73 | PARP1 (0.62) | PARP1ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL3747700 | 0.73 | PARP1 (0.62) | PARP1ALDH1A1HPGDTSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7816371-B2 | Bicycloheteroaryl compounds as P2X7 modulators and uses thereof | RENOVIS, INC. (US) | 2010-10-19 | — | — | US | claimed |