Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 2/20 | 0.39 |
| ▸ | CCND1 | P24385 | 2/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.39 |
| ▸ | F9 | P00740 | 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 | |
|---|---|---|---|---|
| SCHEMBL7917731 | 0.85 | TNF (0.49) | TNFCYP1A2MAPTSMN1; SMN2KDM4E | |
| SCHEMBL8755930 | 0.83 | PLA2G2D (0.53) | CYP1A2CYP2C9CYP2C19HDAC8HDAC6 | |
| SCHEMBL7916817 | 0.82 | AKR1C3 (0.41) | CYP1A2CYP2C9CYP2C19HDAC6MAPT | |
| SCHEMBL7918345 | 0.82 | CYP1A2 (0.40) | CYP1A2CYP2C19MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL1528162 | 0.81 | PLA2G2D (0.54) | CYP1A2CYP2C9CYP2C19HDAC8HDAC6 | |
| SCHEMBL8755335 | 0.80 | MAPT (0.58) | TNFCYP1A2CYP2C9CYP2C19HDAC8 | |
| SCHEMBL7918689 | 0.79 | KDM4E (0.45) | CYP2C9MAPTMEN1KMT2AMAPK1 | |
| SCHEMBL7906709 | 0.79 | CA1 (0.41) | CYP1A2CYP2C9CYP2C19MAPTKMT2A | |
| SCHEMBL7917427 | 0.77 | F2 (0.41) | TNFHDAC6MAPTKMT2AMAPK1 | |
| SCHEMBL16502583 | 0.77 | PLA2G2D (0.50) | CYP1A2CYP2C9CYP2C19HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010090304-A1 | ACYLGUANIDINE DERIVATIVE | アステラス製薬株式会社 (JP) | 2010-08-12 | — | — | WO | disclosed |