Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.57 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.49 |
| ▸ | VDR | P11473 | 1/20 | 0.49 |
| ▸ | AHR | P35869 | 1/20 | 0.49 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.49 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| 1-Naphthol SCHEMBL2016852 | 0.83 | CYP1A2 (0.63) | CYP1A2KMT2AMEN1NPC1RAB9A | |
| SCHEMBL31411912 | 0.83 | KMT2A (0.51) | HDAC4HDAC8CYP1A2SERPINE1CYP1A1 | |
| 1-Naphthol SCHEMBL7584597 | 0.81 | CYP1A2 (0.55) | CYP1A2KMT2AMEN1NPC1RAB9A | |
| SCHEMBL27613029 | 0.80 | HDAC4 (0.66) | HDAC4HDAC8CYP1A2SERPINE1CYP1A1 | |
| SCHEMBL22117162 | 0.80 | HDAC4 (0.53) | HDAC4HDAC8CYP1A2SERPINE1CYP1A1 | |
| 1-Naphthol SCHEMBL558316 | 0.80 | CYP1A2 (0.81) | CYP1A2KMT2AKDM4ETP53MAPT | |
| SCHEMBL312278 | 0.80 | KMT2A (0.56) | HDAC4HDAC8CYP1A2SERPINE1CYP1A1 | |
| SCHEMBL5286981 | 0.79 | BRD4 (0.55) | CYP1A2CYP1A1CYP1B1KMT2ACYP3A4 | |
| SCHEMBL169434 | 0.79 | MTNR1A (0.55) | CYP1A2CYP2A6 | |
| SCHEMBL774076 | 0.79 | CYP1A2 (0.55) | HDAC4HDAC8CYP1A2KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104914079-A | Two-sided Schiff base sensor, synthesis method thereof, and application thereof in fluorescent colorimetric continuous identification of Cu<2+> and H<2>PO<4><-> | UNIV NORTHWEST NORMAL | 2015-09-16 | — | — | CN | disclosed |