Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.42 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | P4HTM | Q9NXG6 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.37 |
| ▸ | CCR8 | P51685 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3620548 | 0.78 | GRM5 (0.51) | GRM5TGFBR1TGFBR2PARP1DHODH | |
| SCHEMBL11576372 | 0.77 | HPGD (0.45) | LMNACYP1A2POLBALDH1A1HPGD | |
| SCHEMBL29455925 | 0.76 | GRM5 (0.50) | GRM5TGFBR1TGFBR2PARP1DHODH | |
| SCHEMBL11546311 | 0.76 | KDM4E (0.43) | CYP2A6KDM4EP4HTMLMNACYP1A2 | |
| SCHEMBL20985616 | 0.74 | KDM4E (0.45) | TGFBR1CYP2A6KDM4EP4HTMLMNA | |
| SCHEMBL22584044 | 0.73 | NPSR1 (0.46) | GRM5TGFBR1TGFBR2PARP1DHODH | |
| SCHEMBL558611 | 0.73 | KDM4E (0.43) | CYP2A6KDM4EP4HTMLMNACYP1A2 | |
| Dipyridyl SCHEMBL20448088 | 0.71 | KDM4E (0.67) | PARP1CYP2A6KDM4EP4HTMLMNA | |
| SCHEMBL19581487 | 0.71 | GRM5 (0.45) | GRM5TGFBR1TGFBR2PARP1DHODH | |
| SCHEMBL2943452 | 0.71 | GRM5 (0.54) | GRM5PARP1DHODHPARP2CDC7 |
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 |
|---|---|---|---|---|---|---|---|
| US-4139623-A | HYPOTENSIVE AGENTS | C-G CORP. (US) | 1979-02-13 | — | — | US | disclosed |
| US-4027027-A | BETA-RECEPTOR-BLOCKERS, HYPOTENSIVES AND VALODILATORS; FOR TREATING ARRYTHMIAS AND ANGINA PECTORIS | CIBA-GEIGY CORPORATION (US) | 1977-05-31 | — | — | US | disclosed |