Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | AKT2 | P31751 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL12816144 | 0.92 | SQOR (0.44) | SQORKDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL12815489 | 0.85 | ESR2 (0.38) | SQORKDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL12816348 | 0.82 | MEN1 (0.37) | KDM4EALDH1A1MAPTRAB9AMEN1 | |
| SCHEMBL12816012 | 0.82 | MEN1 (0.37) | KDM4EALDH1A1MAPTRAB9AMEN1 | |
| SCHEMBL12816811 | 0.81 | ESR2 (0.53) | SQORESR2CYP2A6CYP2B6PSMB5 | |
| SCHEMBL12815897 | 0.81 | ESR2 (0.40) | SQORKDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL12816430 | 0.78 | BACE1 (0.39) | KDM4EALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL12816561 | 0.76 | SQOR (0.44) | SQORKDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL12815721 | 0.76 | MAPT (0.37) | KDM4EALDH1A1MAPTRAB9AMEN1 | |
| SCHEMBL9423370 | 0.75 | PSMB5 (0.49) | SQORKDM4EALDH1A1MAPTRAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012133935-A1 | METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (3) | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-10-04 | — | — | WO | disclosed |