Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7219049 | 0.86 | THRB (0.60) | ESR1ESR2THRBKMT2APLA2G1B | |
| SCHEMBL7218282 | 0.80 | THRB (0.48) | THRBKMT2AATMELANEPLA2G1B | |
| SCHEMBL7219066 | 0.79 | THRB (0.47) | ESR1ESR2THRBKMT2AATM | |
| SCHEMBL27054383 | 0.79 | ESR1 (0.44) | ESR1ESR2KMT2AATMELANE | |
| SCHEMBL19766172 | 0.78 | ESR1 (0.61) | ESR1ESR2KMT2AATMELANE | |
| SCHEMBL1516212 | 0.78 | THRB (0.63) | THRBKMT2AATMELANEPLA2G1B | |
| SCHEMBL16395131 | 0.76 | ESR1 (0.56) | ESR1ESR2KMT2AALDH1A1MAPT | |
| SCHEMBL21583279 | 0.75 | ESR1 (0.60) | ESR1ESR2KMT2AALDH1A1MAPT | |
| SCHEMBL20827825 | 0.74 | THRB (0.58) | THRBKMT2AATMELANEPLA2G1B | |
| SCHEMBL883697 | 0.74 | THRB (0.58) | THRBKMT2AATMELANEPLA2G1B |
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 |
|---|---|---|---|---|---|---|---|
| US-6624236-B1 | Sol-gel-condensable cyclosiloxane(meth) acrylates; dentistry | 3M ESPE AG (DE) | 2003-09-23 | — | — | US | disclosed |
| EP-1141094-B1 | CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS | 3M ESPE AG (DE) | 2002-07-24 | — | — | EP | disclosed |