Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL132494 | 0.77 | ESR2 (0.59) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL11546612 | 0.75 | MAOA (0.40) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL15679182 | 0.75 | MAPK1 (0.41) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL28338218 | 0.75 | MAOA (0.40) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL20528880 | 0.75 | MAOA (0.36) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL6522700 | 0.73 | MTNR1A (0.43) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL9866710 | 0.73 | MAOA (0.46) | MAOABCHECES1ALDH1A1MAPT | |
| Fluorene SCHEMBL473154 | 0.72 | MAOA (0.56) | MAOAKDRADORA2AADORA1BCHE | |
| SCHEMBL20528845 | 0.72 | KDR (0.37) | ESR1ESR2MAOAKDRADORA2A | |
| SCHEMBL23955996 | 0.72 | PTGS2 (0.40) | ESR1ESR2MAOAKDRADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3606967-B1 | DIMETHYL-SILYL-BRIDGED-1-SUBSTITUTED-2-INDENYL METALLOCENE COMPLEXES FOR OLEFIN POLYMERIZATION | SABIC GLOBAL TECHNOLOGIES BV (NL) | 2021-08-11 | — | — | EP | disclosed |