Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 3/20 | 0.59 |
| ▸ | CES2 | O00748 | 2/20 | 0.59 |
| ▸ | FNTA | P49354 | 1/20 | 0.50 |
| ▸ | FNTB | P49356 | 1/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.43 |
| ▸ | PAM | P19021 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11557299 | 1.00 | CES1 (0.59) | CES1CES2FNTAFNTBAKR1B1 | |
| SCHEMBL11557300 | 1.00 | CES1 (0.59) | CES1CES2FNTAFNTBAKR1B1 | |
| SCHEMBL11844417 | 0.81 | AKR1C1 (0.61) | CES1CES2FNTAFNTBAKR1B1 | |
| SCHEMBL11187191 | 0.81 | CES2 (0.50) | CES2KMT2AMEN1MAPTL3MBTL1 | |
| SCHEMBL11187192 | 0.81 | CES2 (0.50) | CES2KMT2AMEN1MAPTL3MBTL1 | |
| SCHEMBL30437861 | 0.80 | AKR1C1 (0.59) | CES1CES2FNTAFNTBKMT2A | |
| SCHEMBL11549783 | 0.79 | CES2 (0.52) | CES1CES2FNTAFNTBAKR1B1 | |
| SCHEMBL11548573 | 0.79 | CES1 (0.52) | CES1CES2FNTAFNTBAKR1B1 | |
| SCHEMBL11548571 | 0.79 | CES1 (0.52) | CES1CES2FNTAFNTBAKR1B1 | |
| SCHEMBL11549787 | 0.79 | CES2 (0.52) | CES1CES2FNTAFNTBAKR1B1 |
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-3957817-A | BRIGHTENERS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-18 | — | — | US | disclosed |