Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2260103 | 0.92 | ALDH1A1 (0.53) | ALDH1A1TSHRHCAR2CYP2C9NPSR1 | |
| Acrylic Acid Methyl Ester SCHEMBL9453506 | 0.89 | ALDH1A1 (0.38) | ALDH1A1TSHRHCAR2CYP2C9MAPT | |
| Vinyl Chloride SCHEMBL5430946 | 0.89 | ALDH1A1 (0.47) | ALDH1A1TSHRHCAR2CYP2C9NPSR1 | |
| Acrylic Acid SCHEMBL17387529 | 0.85 | TSHR (0.49) | ALDH1A1TSHRHCAR2NPSR1MAPT | |
| Methacrylic Acid SCHEMBL6231308 | 0.84 | ALDH1A1 (0.42) | ALDH1A1TSHRHCAR2CYP2C9NPSR1 | |
| Acrylic Acid SCHEMBL11798847 | 0.83 | HCAR2 (0.55) | ALDH1A1TSHRHCAR2CYP2C9NPSR1 | |
| SCHEMBL3742848 | 0.83 | TSHR (0.58) | ALDH1A1TSHRHCAR2NPSR1MAPT | |
| Acrylonitrile SCHEMBL9282459 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TSHRHCAR2CYP2C9NPSR1 | |
| Styrene SCHEMBL8844775 | 0.82 | KMT2A (0.48) | ALDH1A1TSHRNPSR1MAPTMEN1 | |
| Acrylic Acid SCHEMBL10969190 | 0.82 | HCAR2 (0.35) | ALDH1A1HCAR2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4547550-A | Acrylate terpolymers and flexible thermoplastic vinyl chloride polymers | THE GENERAL TIRE & RUBBER COMPANY (US) | 1985-10-15 | — | — | US | disclosed |