Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL40331 | 0.88 | HCAR2 (0.57) | ALDH1A1TSHRHCAR2KMT2AMAPT | |
| 1,1-Dichloroethene SCHEMBL8342218 | 0.87 | ALDH1A1 (0.37) | ALDH1A1TSHRHCAR2CYP2C9KDM4E | |
| Acrylic Acid SCHEMBL11216503 | 0.86 | HCAR2 (0.52) | ALDH1A1TSHRHCAR2KMT2AMAPT | |
| Butadiene SCHEMBL11410298 | 0.86 | HCAR2 (0.52) | ALDH1A1TSHRHCAR2KMT2AMAPT | |
| Acrylonitrile SCHEMBL315873 | 0.85 | HCAR2 (0.51) | ALDH1A1TSHRHCAR2MAPTKDM4E | |
| 1,1-Dichloroethene SCHEMBL6373416 | 0.83 | HCAR2 (0.52) | ALDH1A1TSHRHCAR2KMT2AMAPT | |
| Acrylonitrile SCHEMBL3403014 | 0.83 | HCAR2 (0.54) | ALDH1A1TSHRHCAR2MAPTKDM4E | |
| Acrylic Acid SCHEMBL10969441 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRHCAR2CYP2C9KMT2A | |
| Methacrylic Acid SCHEMBL3440748 | 0.81 | HCAR2 (0.50) | ALDH1A1TSHRHCAR2KMT2AMAPT | |
| Acrylonitrile SCHEMBL8018394 | 0.81 | HCAR2 (0.41) | ALDH1A1TSHRHCAR2KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| JP-7305037-A | — | — | None | — | — | JP | disclosed |
| JP-H07305037-A | PRODUCT PRODUCED BY USING ADHESIVE COMPOSITION | TREMCO INC | 1995-11-21 | — | — | JP | disclosed |