Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19624236 | 0.80 | ESR1 (0.45) | ESR1CES2CES1SMN1; SMN2NPSR1 | |
| SCHEMBL13651331 | 0.80 | ESR1 (0.45) | ESR1CES2CES1SMN1; SMN2NPSR1 | |
| SCHEMBL11844374 | 0.78 | ESR1 (0.56) | ESR1CES2CES1LMNAMAPT | |
| SCHEMBL3902058 | 0.78 | ESR1 (0.56) | ESR1CES2CES1LMNAMAPT | |
| SCHEMBL1035354 | 0.78 | ESR1 (0.56) | ESR1CES2CES1LMNAMAPT | |
| SCHEMBL23278527 | 0.75 | ESR1 (0.61) | ESR1CES2CES1SMN1; SMN2MAPT | |
| SCHEMBL8017607 | 0.74 | CES2 (0.44) | ESR1CES2CES1SMN1; SMN2NPSR1 | |
| SCHEMBL15171343 | 0.73 | ESR1 (0.43) | ESR1CES2CES1SMN1; SMN2NPSR1 | |
| SCHEMBL16160124 | 0.73 | ESR1 (0.44) | ESR1SMN1; SMN2NPSR1LMNAPTGS2 | |
| SCHEMBL58000 | 0.73 | ESR1 (0.52) | ESR1CES2CES1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0250090-B1 | STORAGE STABLE LATENTLY CURABLE ACRYLIC FORMULATIONS EMPLOYING POLYMERIC HYDROPEROXIDES | LOCTITE CORPORATION (US) | 1992-01-29 | — | — | EP | claimed |
| EP-1219582-A4 | METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE | MITSUI CHEMICALS INC (JP) | 2004-09-08 | — | — | EP | disclosed |
| WO-2001016062-A1 | METHOD OF DEHYDROGENATING TRIISOPROPYLBENZENE AND DIISOPROPYLBENZENE | MITSUI CHEMICALS, INCORPORATED (JP) | 2001-03-08 | — | — | WO | disclosed |