Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TYMS | P04818 | 1/20 | 0.41 |
| ▸ | PMM2 | O15305 | 1/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 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 | |
|---|---|---|---|---|
| SCHEMBL11801845 | 0.88 | TSHR (0.45) | ALDH1A1TDP1CYP3A4TSHRCYP2D6 | |
| SCHEMBL30946524 | 0.88 | TSHR (0.45) | ALDH1A1TDP1CYP3A4TSHRCYP2D6 | |
| SCHEMBL12098391 | 0.87 | S100A4 (0.43) | ALDH1A1TDP1TYMSPMM2MPI | |
| SCHEMBL7063757 | 0.86 | GPR35 (0.48) | ALDH1A1TYMSCYP3A4TSHRCYP2D6 | |
| SCHEMBL9452627 | 0.83 | ALDH1A1 (0.52) | ALDH1A1TDP1PMM2MPICYP3A4 | |
| SCHEMBL25411924 | 0.83 | ALDH1A1 (0.37) | ALDH1A1TDP1TYMSPMM2MPI | |
| SCHEMBL28451753 | 0.83 | ALDH1A1 (0.37) | ALDH1A1TDP1TYMSPMM2MPI | |
| SCHEMBL2494137 | 0.82 | TDP1 (0.51) | ALDH1A1TDP1LMNAGRIN2DGRIN3B | |
| SCHEMBL30439274 | 0.82 | TDP1 (0.51) | ALDH1A1TDP1LMNAGRIN2DGRIN3B | |
| SCHEMBL10591279 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TDP1TYMSCYP3A4TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109776490-B | Non-aromatic amine micromolecule photoelectric material and preparation and application thereof | 华南理工大学 | 2021-06-08 | — | — | CN | disclosed |
| CN-103555322-B | New organic electroluminescent compounds and the organic electroluminescent device of this compound of use | 罗门哈斯电子材料韩国有限公司 | 2016-08-17 | — | — | CN | disclosed |
| WO-2010107244-A2 | NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | DOW ADVANCED DISPLAY MATERIALS, LTD. (KR) | 2010-09-23 | — | — | WO | disclosed |