Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.35 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.35 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL666720 | 0.76 | LMNA (0.57) | LMNACYP2A6IDO1ALDH1A1HSD17B10 | |
| SCHEMBL11266187 | 0.75 | LMNA (0.47) | LMNACYP2A6IDO1ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL11255237 | 0.73 | LMNA (0.44) | LMNACYP2A6IDO1ALDH1A1HSD17B10 | |
| 1,4-Dichlorobenzene SCHEMBL5191 | 0.73 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL11243685 | 0.73 | — | — | |
| SCHEMBL21632449 | 0.71 | CYP2A6 (0.42) | LMNACYP2A6ALDH1A1HSD17B10ALOX15 | |
| SCHEMBL14059916 | 0.71 | CYP2A6 (0.42) | LMNACYP2A6ALDH1A1HSD17B10ALOX15 | |
| SCHEMBL14318415 | 0.71 | LMNA (0.50) | LMNACYP2A6IDO1ALDH1A1HSD17B10 | |
| SCHEMBL5213200 | 0.71 | CHKA (0.55) | LMNACYP2A6ALDH1A1HSD17B10ALOX15 | |
| SCHEMBL31116653 | 0.71 | ALDH1A1 (0.69) | LMNACYP2A6ALDH1A1HSD17B10ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013035650-A9 | METHOD FOR PRODUCING ALPHA - HYDROXY KETONE COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-03-13 | — | — | WO | disclosed |
| WO-2013035650-A1 | METHOD FOR PRODUCING ALPHA - HYDROXY KETONE COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-03-14 | — | — | WO | disclosed |