Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1612190 | 0.66 | TSHR (0.49) | ALDH1A1MAPTHSD17B10GAANPSR1 | |
| SCHEMBL30954084 | 0.64 | NR1H2 (0.36) | ALDH1A1MAPTHSD17B10NPSR1MEN1 | |
| SCHEMBL12148612 | 0.63 | CA12 (0.48) | ALDH1A1MAPTHSD17B10HPGDMEN1 | |
| SCHEMBL6204940 | 0.61 | NPC1 (0.47) | ALDH1A1HSD17B10GAAHPGDNPSR1 | |
| SCHEMBL26673197 | 0.61 | SLC6A3 (0.43) | ALDH1A1MAPTGAANPSR1MEN1 | |
| SCHEMBL9864839 | 0.60 | TSHR (0.46) | ALDH1A1MAPTHSD17B10HPGDNPSR1 | |
| SCHEMBL11732434 | 0.60 | KMT2A (0.53) | ALDH1A1MAPTMEN1KMT2ATSHR | |
| SCHEMBL20455697 | 0.60 | CES2 (0.42) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL25064382 | 0.60 | ALDH1A1 (0.51) | ALDH1A1MAPTHSD17B10GAAHPGD | |
| SCHEMBL14532139 | 0.59 | MGAM (0.46) | ALDH1A1HSD17B10GAAKDM4EALOX15 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0509845-A1 | (+) and (-) enantiomers of 5-aliphatic-6-(benzoxazinyl- or benzothiazinyl)-2,3,4,5-tetrahydropyridazin-3-ones | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-10-21 | — | — | EP | disclosed |
| US-5081242-A | Cardiotonic and bronchodilator agents; phosphodiesterase inhibitors | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-01-14 | — | — | US | disclosed |
| US-4766118-A | CARDIOTONIC AGENTS, PHOSPHODIESTERASE INHIBITORS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1988-08-23 | — | — | US | disclosed |
| EP-0272914-A2 | 6-Benzoxazinyl- and 6-benzothiazinyl-2,3,4,5-tetrahydropyridazin-3-ones | ORTHO PHARMACEUTICAL CORPORATION (US) | 1988-06-29 | — | — | EP | disclosed |
| US-4721784-A | MUSCLE RELAXANTS, BRONCHODILATOR AGENTS, CARDIOTONIC AGENTS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1988-01-26 | — | — | US | disclosed |