Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL194159 | 0.89 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL119524 | 0.89 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL28184754 | 0.89 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL28400557 | 0.89 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL8366099 | 0.89 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL4409490 | 0.85 | CYP2A6 (0.67) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL1154787 | 0.85 | CYP2A6 (0.67) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL27338517 | 0.85 | CYP2A6 (0.67) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL27489552 | 0.84 | CYP2A6 (0.47) | CYP2A6ALOX12CES2CES1TDP1 | |
| Naphthalene SCHEMBL6137165 | 0.81 | CYP2A6 (0.73) | CYP2A6ALOX12TDP1CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105339402-B | Aromatic hydrocarbon formaldehyde resin, modified aromatic hydrocarbon formaldehyde resin, epoxy resin, and methods for producing these | 三菱瓦斯化学株式会社 | 2017-07-28 | — | — | CN | disclosed |
| CN-105339402-A | Aromatic hydrocarbon formaldehyde resin, modified aromatic hydrocarbon formaldehyde resin, epoxy resin, and methods for producing these | MITSUBISHI GAS CHEMICAL CO | 2016-02-17 | — | — | CN | disclosed |