Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | RARG | P13631 | 3/20 | 0.33 |
| ▸ | RXRA | P19793 | 3/20 | 0.33 |
| ▸ | PPARG | P37231 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.33 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2868170 | 0.81 | SMN1; SMN2 (0.50) | POLBALDH1A1CYP1A2SMN1; SMN2KDM4E | |
| SCHEMBL2947022 | 0.78 | PTGS2 (0.47) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL15907991 | 0.76 | GABRA1 (0.37) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL10601723 | 0.76 | GABRA1 (0.37) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL10601737 | 0.76 | GABRA1 (0.37) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL12225262 | 0.76 | GABRA1 (0.37) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL8903316 | 0.76 | GABRA1 (0.38) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL1304653 | 0.76 | GABRA1 (0.33) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL10791329 | 0.74 | GABRA1 (0.36) | GABRA1GABRB2POLBRARGRXRA | |
| SCHEMBL2517646 | 0.74 | GABRA1 (0.36) | GABRA1GABRB2POLBRARGRXRA |
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-20090048408-A1 | CATALYST COMPRISING HETEROLEPTIC ALUMINUM AND COBALT COMPOUNDS AND A METHOD OF PREPARING POLYBUTADIENE USING THE SAME | KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) | 2009-02-19 | — | — | US | claimed |