Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30625687 | 0.83 | KMT2A (0.50) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL3609310 | 0.81 | TSHR (0.58) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL20042499 | 0.81 | TSHR (0.45) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL11957029 | 0.80 | ALDH1A1 (0.60) | ALDH1A1KDM4EGAAMAPTKEAP1 | |
| SCHEMBL12028370 | 0.80 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAAMAPTKEAP1 | |
| SCHEMBL12028371 | 0.79 | ALDH1A1 (0.40) | ALDH1A1KDM4EGAAMAPTKEAP1 | |
| SCHEMBL29403462 | 0.79 | GABRA1 (0.43) | ALDH1A1KDM4EGAAMAPTKEAP1 | |
| SCHEMBL12123475 | 0.79 | ALDH1A1 (0.59) | ALDH1A1KDM4EGAAMAPTKEAP1 | |
| SCHEMBL29824592 | 0.78 | PRSS1 (0.55) | ALDH1A1KDM4EGAAMAPTKEAP1 | |
| SCHEMBL15357812 | 0.77 | MAPT (0.42) | ALDH1A1KDM4EGAAMAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-114957282-A | Near-infrared absorption organic small-molecule photovoltaic material based on benzothiophene/fluorine substituted benzothiophene derivative | 东华理工大学 | 2022-08-30 | — | — | CN | disclosed |
| US-20210071004-A1 | NEAR-INFRARED ABSORBING DYE, OPTICAL FILTER, AND IMAGING DEVICE | AGC Inc. (JP) | 2021-03-11 | — | — | US | disclosed |