Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | LPL | P06858 | 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 | |
|---|---|---|---|---|
| SCHEMBL27739618 | 0.84 | MAPK1 (0.42) | L3MBTL1TSHRMAPK1ATMTDP1 | |
| SCHEMBL3278647 | 0.82 | PTGS1 (0.49) | TSHRLMNAAKR1C3AKR1C2CYP2C9 | |
| SCHEMBL3278653 | 0.82 | PTGS1 (0.49) | TSHRLMNAAKR1C3AKR1C2CYP2C9 | |
| SCHEMBL13065065 | 0.81 | ESR1 (0.30) | — | |
| SCHEMBL29047003 | 0.81 | SRD5A2 (0.39) | L3MBTL1TDP1ALDH1A1LMNAHPGD | |
| SCHEMBL13631877 | 0.81 | HDAC8 (0.32) | TDP1LMNAMAPTCYP2C9CYP2C19 | |
| SCHEMBL7623081 | 0.81 | TYR (0.50) | L3MBTL1MAPK1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL23580752 | 0.79 | ADRB2 (0.40) | TSHRMAPK1TDP1LMNAHPGD | |
| SCHEMBL9714748 | 0.79 | ESR1 (0.54) | TDP1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL19060475 | 0.79 | CYP1A2 (0.38) | ALDH1A1HPGDCYP2C9CYP2C19 |
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-4355184-A | BY REACTING AN ALDEHYDE WITH AN ALKALI METAL SALT OF ACETOACETIC | NIPPON SODA COMPANY LIMITED (JP) | 1982-10-19 | — | — | US | disclosed |