Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.55 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | NPY2R | P49146 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | APEX1 | P27695 | 2/20 | 0.48 |
| ▸ | F7 | P08709 | 1/20 | 0.48 |
| ▸ | F3 | P13726 | 1/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1156515 | 0.90 | HRH4 (0.60) | HRH4PIN1CYP19A1SMAD3ALDH1A1 | |
| SCHEMBL1260652 | 0.90 | HRH4 (0.60) | HRH4PIN1CYP19A1SMAD3ALDH1A1 | |
| SCHEMBL8794605 | 0.89 | HRH4 (0.59) | HRH4PIN1CYP19A1SMAD3ALDH1A1 | |
| SCHEMBL27885276 | 0.83 | HRH4 (0.61) | HRH4CYP19A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL8277586 | 0.82 | HRH4 (0.58) | HRH4CYP19A1ALDH1A1KMT2AMEN1 | |
| Dimethylformamide SCHEMBL28004370 | 0.81 | APEX1 (0.45) | HRH4PIN1CYP19A1ALDH1A1KMT2A | |
| SCHEMBL12862878 | 0.80 | HRH4 (0.62) | HRH4PIN1CYP19A1ALDH1A1KMT2A | |
| Dimethylformamide SCHEMBL28004372 | 0.80 | APEX1 (0.44) | HRH4ALDH1A1KMT2AMEN1POLB | |
| SCHEMBL396212 | 0.79 | HRH4 (0.60) | HRH4SMAD3ALDH1A1KMT2AMEN1 | |
| SCHEMBL931628 | 0.79 | NHERF1 (0.52) | HRH4CYP19A1SMAD3KMT2AMEN1 |
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-104334553-A | Amino-indolyl-substituted imidazolyl-pyrimidines and their use as medicaments | BOEHRINGER INGELHEIM INT | 2015-02-04 | — | — | CN | disclosed |