Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21173222 | 0.94 | CASP3 (0.39) | PKMMAPTALDH1A1GAACASP3 | |
| SCHEMBL21173228 | 0.83 | USP8 (0.40) | PKMMAPTALDH1A1GAAMEN1 | |
| SCHEMBL21173226 | 0.83 | MAPT (0.39) | PKMMAPTALDH1A1GAAMEN1 | |
| SCHEMBL25612614 | 0.81 | USP8 (0.40) | PKMMAPTALDH1A1GAAMEN1 | |
| SCHEMBL21173225 | 0.81 | USP8 (0.40) | PKMMAPTALDH1A1GAAMEN1 | |
| SCHEMBL2681526 | 0.80 | S100A4 (0.42) | PKMMAPTALDH1A1GAAMAOA | |
| SCHEMBL2681524 | 0.80 | S100A4 (0.42) | PKMMAPTALDH1A1GAAMAOA | |
| SCHEMBL16977316 | 0.80 | S100A4 (0.42) | PKMMAPTALDH1A1GAAMAOA | |
| SCHEMBL24960484 | 0.79 | MAPT (0.36) | PKMMAPTALDH1A1GAAMEN1 | |
| SCHEMBL22544872 | 0.79 | S100A4 (0.41) | PKMMAPTALDH1A1MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019137354-A1 | THIOPHENE-BASED FUSED AROMATIC SYSTEMS | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2019-07-18 | — | — | WO | disclosed |