Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL1170738 | 0.93 | TDP1 (0.35) | TSHRALDH1A1TDP1 | |
| SCHEMBL28946004 | 0.88 | CHRM2 (0.33) | TSHRALDH1A1TDP1 | |
| SCHEMBL753790 | 0.84 | ALDH1A1 (0.37) | TSHRALDH1A1TDP1 | |
| SCHEMBL2895677 | 0.82 | LTA4H (0.31) | — | |
| SCHEMBL18343724 | 0.81 | TSHR (0.33) | TSHR | |
| SCHEMBL877118 | 0.81 | ALDH1A1 (0.32) | TSHRMAPK1ALDH1A1 | |
| SCHEMBL28491323 | 0.79 | MEN1 (0.38) | TDP1 | |
| SCHEMBL28559530 | 0.77 | HTR6 (0.31) | — | |
| SCHEMBL28540568 | 0.76 | — | — | |
| SCHEMBL29154499 | 0.76 | — | — |
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-2020148170-A1 | POLY-OH-FUNCTIONAL TRISILOXANES, PRODUCTION THEREOF, AND USE THEREOF FOR PRODUCING POLYURETHANE FOAMS | EVONIK OPERATIONS GMBH (DE) | 2020-07-23 | — | — | WO | claimed |
| WO-2020148170-A1 | POLY-OH-FUNCTIONAL TRISILOXANES, PRODUCTION THEREOF, AND USE THEREOF FOR PRODUCING POLYURETHANE FOAMS | EVONIK OPERATIONS GMBH (DE) | 2020-07-23 | — | — | WO | disclosed |