Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | LDHB | P07195 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.32 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Isobutane SCHEMBL31392695 | 0.78 | — | — | |
| Isobutane SCHEMBL534103 | 0.78 | ACHE (0.64) | ACHETP53SLC7A5LMNAALOX15 | |
| Carbamic Acid SCHEMBL10822769 | 0.78 | — | — | |
| Carbamic Acid SCHEMBL28646105 | 0.76 | ACHE (0.50) | ACHETP53SLC7A5LMNAALOX15 | |
| Isobutane SCHEMBL28745192 | 0.74 | ACHE (0.58) | ACHETP53SLC7A5LMNAALOX15 | |
| Carbamic Acid SCHEMBL10822619 | 0.74 | — | — | |
| Isopropylamine SCHEMBL944431 | 0.74 | — | — | |
| Carbamic Acid SCHEMBL29148156 | 0.74 | ACHE (0.58) | ACHETP53SLC7A5LMNAALOX15 | |
| Carbamic Acid SCHEMBL201906 | 0.73 | — | — | |
| Carbamic Acid SCHEMBL3845940 | 0.73 | — | — |
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-108026230-A | Antifouling composition | 巴斯夫欧洲公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-107922571-A | Antifouling composition | 巴斯夫欧洲公司 | 2018-04-17 | — | — | CN | disclosed |