Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.56 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | HPGD | P15428 | 5/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.56 |
| ▸ | CLK2 | P49760 | 1/20 | 0.56 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | TOP2A | P11388 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL9775950 | 0.99 | KCNH2 (0.56) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| Water SCHEMBL9775943 | 0.99 | KCNH2 (0.56) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| SCHEMBL9526321 | 0.89 | ALDH1A1 (0.49) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| SCHEMBL9526209 | 0.88 | KDM4E (0.68) | KDM4EALDH1A1HPGDHSD17B10POLB | |
| SCHEMBL9786140 | 0.88 | DPP4 (0.53) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| Water SCHEMBL9775975 | 0.88 | KDM4E (0.67) | KDM4EALDH1A1HPGDHSD17B10POLB | |
| SCHEMBL9786167 | 0.87 | DPP4 (0.53) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| SCHEMBL9775885 | 0.86 | ALDH1A1 (0.47) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| SCHEMBL9775921 | 0.86 | ALDH1A1 (0.60) | KCNH2HRH3KDM4EALDH1A1HPGD | |
| SCHEMBL9775905 | 0.86 | KDM4E (0.49) | KDM4EALDH1A1HPGDHSD17B10LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5004745-A | Benzo[1,8]naphthyridine derivatives, their preparation and the compositions which contain them | LABORATOIRE ROGER BELLON (FR) | 1991-04-02 | — | — | US | disclosed |
| US-4990515-A | Chemical intermediates | RHONE-POULENC SANTE (FR) | 1991-02-05 | — | — | US | disclosed |
| US-4970213-A | Benzo(1,8)naphthyridine derivatives as intermediates | RHONE-POULENC SANTE (FR) | 1990-11-13 | — | — | US | disclosed |