Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | FABP3 | P05413 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22453406 | 0.92 | CYP1A2 (0.44) | KDM4CCYP1A2CYP2C9HPGDCYP3A4 | |
| SCHEMBL22452446 | 0.90 | KDM4C (0.46) | KDM4CDHODHCYP1A2CYP2C9HPGD | |
| SCHEMBL22453288 | 0.89 | MEN1 (0.57) | KDM4CDHODHCYP1A2CYP2C9HPGD | |
| SCHEMBL22453290 | 0.89 | AKR1C3 (0.48) | KDM4CDHODHHPGDMEN1KMT2A | |
| SCHEMBL22453458 | 0.87 | MEN1 (0.46) | KDM4CDHODHHPGDMEN1KMT2A | |
| SCHEMBL22452450 | 0.83 | MEN1 (0.46) | KDM4CDHODHHPGDMEN1KMT2A | |
| SCHEMBL22453404 | 0.82 | CYP1A2 (0.44) | KDM4CCYP1A2CYP2C9HPGDCYP3A4 | |
| SCHEMBL22453439 | 0.81 | TUBB4A (0.46) | DHODHCYP1A2CYP2C9CYP2C19LMNA | |
| SCHEMBL22453599 | 0.81 | TUBB4A (0.46) | KDM4CCYP1A2CYP2C9HPGDCYP3A4 | |
| SCHEMBL22452953 | 0.80 | TUBB4A (0.44) | KDM4CDHODHCYP1A2CYP2C9CYP2C19 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |