Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NPY1R | P25929 | 1/20 | 0.45 |
| ▸ | NPY2R | P49146 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6057357 | 0.88 | ALDH1A1 (0.79) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL28020077 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRMAPTMEN1KMT2A | |
| SCHEMBL28020503 | 0.81 | KDM4E (0.49) | ALDH1A1ADRB2ADRB1ADRB3MAPT | |
| SCHEMBL28020526 | 0.81 | ALDH1A1 (0.59) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| Toluic Acid SCHEMBL27303668 | 0.80 | ALDH1A1 (0.75) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL28020139 | 0.80 | TSHR (0.63) | ALDH1A1TSHRMAPTTP53ADRA1D | |
| SCHEMBL29387332 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL42787 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL8144263 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL17797889 | 0.78 | ALDH1A1 (0.62) | ALDH1A1TSHRADRB2ADRB1ADRB3 |
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-104829756-A | Solid catalyst component for olefin polymerization, and preparation method and application thereof | CHINESE ACAD INST CHEMISTRY | 2015-08-12 | — | — | CN | disclosed |