Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL11011055 | 0.95 | TSHR (0.61) | TSHRALDH1A1LMNAALOX12ACHE | |
| Toluene SCHEMBL8147547 | 0.95 | TSHR (0.61) | TSHRALDH1A1LMNAALOX12ACHE | |
| Heptane SCHEMBL6130166 | 0.95 | TSHR (0.61) | TSHRALDH1A1LMNAALOX12ACHE | |
| Toluene SCHEMBL782975 | 0.95 | TSHR (0.61) | TSHRALDH1A1LMNAALOX12ACHE | |
| Toluene SCHEMBL11023406 | 0.95 | TSHR (0.61) | TSHRALDH1A1LMNAALOX12ACHE | |
| Toluene SCHEMBL5084004 | 0.89 | TSHR (0.56) | TSHRALDH1A1LMNAALOX12ACHE | |
| Toluene SCHEMBL20497325 | 0.88 | TSHR (0.53) | TSHRALDH1A1SOAT2SOAT1FAAH | |
| Toluene SCHEMBL998833 | 0.87 | TSHR (0.58) | TSHRALDH1A1LMNAALOX12ACHE | |
| Toluene SCHEMBL20497322 | 0.87 | TSHR (0.52) | TSHRALDH1A1SOAT2SOAT1FAAH | |
| Heptane SCHEMBL4604507 | 0.83 | TSHR (0.47) | TSHRALDH1A1HTTSOAT2SOAT1 |
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-5461127-A | Comprising group 4 metal, cyclic hydrocarbon, ligands, Lewis base; addition polymerization | IDEMITSU KOSAN CO., LTD. (JP) | 1995-10-24 | — | — | US | disclosed |