Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1082231 | 0.90 | TSHR (0.53) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL5409642 | 0.86 | TSHR (0.53) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL5422294 | 0.86 | TSHR (0.53) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL5422299 | 0.86 | TSHR (0.53) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL5409637 | 0.86 | TSHR (0.53) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL5409634 | 0.86 | TSHR (0.53) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL1072622 | 0.85 | TSHR (0.49) | TSHRTP53PDCD1CD274ESR1 | |
| Ethylene Glycol SCHEMBL16487425 | 0.84 | CYP1A1 (0.48) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL8078600 | 0.83 | NPC1 (0.55) | TSHRTP53PDCD1CD274ESR1 | |
| SCHEMBL28848169 | 0.82 | LMNA (0.43) | TSHRKMT2AMEN1POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-109180843-B | Non-phthalate compounds as electron donors for polyolefin catalysts | 美国台塑公司 | 2022-03-01 | — | — | CN | claimed |
| CN-109180843-B | Non-phthalate compounds as electron donors for polyolefin catalysts | 美国台塑公司 | 2022-03-01 | — | — | CN | disclosed |