Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.45 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | DAO | P14920 | 2/20 | 0.40 |
| ▸ | DDO | Q99489 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RHEB | Q15382 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2899660 | 0.88 | DDAH1 (0.55) | CHEK1DDAH1DAODDOTDP1 | |
| SCHEMBL6582523 | 0.83 | DDAH1 (0.42) | CHEK1DDAH1DAODDOTDP1 | |
| SCHEMBL11498419 | 0.83 | LIPG (0.40) | CHEK1 | |
| SCHEMBL15767180 | 0.82 | CHEK1 (0.41) | CHEK1DDAH1PARP1HTR6KDM4E | |
| SCHEMBL9589046 | 0.81 | GRIN1 (0.49) | CHEK1PARP1TDP1NPSR1RHEB | |
| SCHEMBL3968950 | 0.80 | DDAH1 (0.50) | CHEK1DDAH1DAODDOALDH1A1 | |
| SCHEMBL8169941 | 0.80 | POLB (0.46) | PARP1 | |
| SCHEMBL4346855 | 0.79 | MGAM (0.51) | TDP1ALDH1A1 | |
| SCHEMBL15767459 | 0.78 | CACNA1H (0.43) | CHEK1PARP1ALDH1A1HTR6 | |
| SCHEMBL5788740 | 0.77 | PARP1 (0.54) | CHEK1DDAH1PARP1DAODDO |
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-1417182-A1 | COMPOUNDS USEFUL FOR TREATMENT OR PREVENTION OF DISEASE MEDIATED BY ALPHA-2B-ADRENOCEPTOR | Oy Juvantia Pharma Ltd (FI) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003008387-A1 | COMPOUNDS USEFUL FOR TREATMENT OR PREVENTION OF DISEASE MEDIATED BY ALPHA-2B-ADRENOCEPTOR | OY JUVANTIA PHARMA LTD (FI) | 2003-01-30 | — | — | WO | disclosed |