Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2774413 | 0.91 | AKR1C3 (0.50) | AKR1C3KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL28349681 | 0.77 | KMT2A (0.50) | AKR1C3HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL525211 | 0.75 | AKR1C3 (0.55) | AKR1C3CYP3A4CYP2C9CYP2C19CYP24A1 | |
| SCHEMBL525210 | 0.75 | AKR1C3 (0.55) | AKR1C3CYP3A4CYP2C9CYP2C19CYP24A1 | |
| SCHEMBL2202450 | 0.74 | KMT2A (0.55) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL17102367 | 0.73 | AKR1C3 (0.48) | AKR1C3HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL11032441 | 0.73 | HTT (0.43) | AKR1C3CYP1A2CYP2C9CYP2C19AKR1C1 | |
| SCHEMBL4731168 | 0.72 | AKR1C3 (0.47) | AKR1C3KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL11363802 | 0.71 | KDM4E (0.45) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8986563 | 0.70 | CYP19A1 (0.43) | AKR1C3KDM4ECYP19A1CYP11B2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-57212143-A | — | — | None | — | — | JP | disclosed |
| JP-S57212143-A | METHACRYLIC ACID ESTER COMPOUND | DAICEL CHEM IND LTD | 1982-12-27 | — | — | JP | disclosed |