Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | VCP | P55072 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL27719471 | 0.84 | LMNA (0.50) | LMNATSHRALOX12ACHEGABRA1 | |
| Biphenyl SCHEMBL22121584 | 0.84 | ALDH1A1 (0.41) | LMNATSHRGABRA1GABRB2MAPT | |
| Toluene SCHEMBL11027465 | 0.84 | LMNA (0.50) | LMNATSHRALOX12ACHEGABRA1 | |
| Benzene SCHEMBL28293157 | 0.83 | GABRA1 (0.36) | TSHRGABRA1GABRB2 | |
| Benzene SCHEMBL11866495 | 0.83 | GABRA1 (0.36) | TSHRGABRA1GABRB2 | |
| Fluorobenzene SCHEMBL28129393 | 0.81 | GABRA1 (0.35) | TSHRGABRA1GABRB2MEN1KMT2A | |
| Toluene SCHEMBL28728282 | 0.81 | MIF (0.47) | LMNATSHRALOX12ACHEMEN1 | |
| Chlorobenzene SCHEMBL28239447 | 0.81 | TSHR (0.46) | LMNATSHRGABRA1GABRB2MEN1 | |
| Toluene SCHEMBL17981108 | 0.81 | LMNA (0.46) | LMNATSHRALOX12ACHEGABRA1 | |
| SCHEMBL17961601 | 0.79 | CYP3A4 (0.45) | LMNATSHRGABRA1GABRB2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1422262-A | 2-benzothiazolyl urea derivatives and their use as protein kinase inhibitors | ABBOTT GMBH & CO KG (DE) | 2003-06-04 | — | — | CN | disclosed |