Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL26771562 | 0.85 | POLB (0.40) | MAPTHSD11B1POLBHSD17B10PARP1 | |
| SCHEMBL12086634 | 0.74 | ALDH1A1 (0.37) | MAPTHSD11B1KMT2AALDH1A1MEN1 | |
| SCHEMBL29209093 | 0.74 | MAPT (0.44) | MAPTHSD11B1POLBHSD17B10PARP1 | |
| SCHEMBL1450379 | 0.71 | BRD4 (0.51) | MAPTPOLBHSD17B10PARP1ALDH1A1 | |
| SCHEMBL24307263 | 0.69 | MMP12 (0.40) | HSD17B10KMT2AALDH1A1MEN1GAA | |
| SCHEMBL754751 | 0.69 | PGR (0.42) | HSD11B1BRD4 | |
| SCHEMBL18128201 | 0.68 | POLB (0.49) | MAPTPOLBHSD17B10PARP1KMT2A | |
| SCHEMBL29209123 | 0.68 | MAPT (0.47) | MAPTPOLBHSD17B10PARP1KMT2A | |
| SCHEMBL24307264 | 0.68 | MMP12 (0.40) | MAPTPOLBHSD17B10KMT2AALDH1A1 | |
| SCHEMBL13901417 | 0.67 | POLB (0.48) | MAPTPOLBHSD17B10PARP1KMT2A |
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-4219461-A1 | TETRAHYDROISOQUINOLINE DERIVATIVE AND USE THEREOF | Medshine Discovery Inc. (CN) | 2023-08-02 | — | — | EP | disclosed |
| WO-2022063094-A1 | TETRAHYDROISOQUINOLINE DERIVATIVE AND USE THEREOF | 南京明德新药研发有限公司 | 2022-03-31 | — | — | WO | disclosed |