Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 2/20 | 0.31 |
| ▸ | PTPRC | P08575 | 1/20 | 0.31 |
| ▸ | PTPRG | P23470 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL17713325 | 0.85 | PYCR1 (0.41) | ALDH1A1HTR2ASLC6A4KCNH2LMNA | |
| SCHEMBL3454581 | 0.81 | ALDH1A1 (0.37) | ALDH1A1HTR2ASLC6A4KCNH2LMNA | |
| SCHEMBL27860623 | 0.81 | TDP1 (0.41) | ALDH1A1LMNASMN1; SMN2HPGDHTT | |
| SCHEMBL28861293 | 0.81 | HSP90AA1 (0.39) | ALDH1A1HPGDERN1HTTPTPRC | |
| SCHEMBL25292281 | 0.78 | HTR2A (0.38) | ALDH1A1HTR2ASLC6A4KCNH2LMNA | |
| SCHEMBL14405277 | 0.78 | SMN1; SMN2 (0.36) | ALDH1A1LMNASMN1; SMN2NPSR1HPGD | |
| SCHEMBL26620876 | 0.78 | ERN1 (0.48) | ALDH1A1SMN1; SMN2HPGDERN1HTT | |
| SCHEMBL1487567 | 0.78 | PDPK1 (0.35) | ALDH1A1HTR2ALMNASMN1; SMN2ERN1 | |
| SCHEMBL7591050 | 0.77 | HSP90AA1 (0.39) | ALDH1A1ERN1PYCR1 | |
| SCHEMBL28099903 | 0.76 | CYP2A6 (0.38) | HTR2AERN1CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993008166-A1 | BENZO-ISOQUINOLINE DERIVATIVES AND ANALOGS AND THEIR USE IN THERAPEUTICS | THE UPJOHN COMPANY (US) | 1993-04-29 | — | — | WO | disclosed |
| EP-0539209-A1 | Benzo-isoquinoline derivatives and analogs and their use in therapeutics | THE UPJOHN COMPANY (US) | 1993-04-28 | — | — | EP | disclosed |