Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 4/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CES1 | P23141 | 4/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3039302 | 0.80 | AKR1C1 (0.53) | AKR1C1AKR1C2AKR1C3MTNR1AMTNR1B | |
| SCHEMBL3039305 | 0.80 | AKR1C1 (0.53) | AKR1C1AKR1C2AKR1C3MTNR1AMTNR1B | |
| SCHEMBL348321 | 0.80 | AKR1C1 (0.53) | AKR1C1AKR1C2AKR1C3MTNR1AMTNR1B | |
| SCHEMBL4681821 | 0.78 | AKR1C1 (0.52) | AKR1C1AKR1C2AKR1C3PTGS2KMT2A | |
| SCHEMBL4650345 | 0.78 | AKR1C1 (0.52) | AKR1C1AKR1C2AKR1C3PTGS2KMT2A | |
| SCHEMBL27713864 | 0.78 | AKR1C1 (0.47) | AKR1C1AKR1C2AKR1C3MTNR1AMTNR1B | |
| SCHEMBL14698518 | 0.78 | AKR1C1 (0.55) | AKR1C1AKR1C2AKR1C3PTGS2KMT2A | |
| SCHEMBL14698519 | 0.78 | AKR1C1 (0.55) | AKR1C1AKR1C2AKR1C3PTGS2KMT2A | |
| SCHEMBL8041709 | 0.77 | AKR1C1 (0.50) | AKR1C1AKR1C2AKR1C3MTNR1AMTNR1B | |
| SCHEMBL6259485 | 0.77 | AKR1C1 (0.50) | AKR1C1AKR1C2AKR1C3MTNR1AMTNR1B |
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-5922324-A | ADJUSTING THE PH OF PROPOLIS TO 5.5-7.0 TO IMPROVE THE WATER-SOLUBILITY | KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) | 1999-07-13 | — | — | US | claimed |