Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 11/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5822423 | 0.92 | TP53 (0.43) | TP53HTR6ALDH1A1KDM4EKMT2A | |
| SCHEMBL5798268 | 0.86 | TP53 (0.47) | TP53ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL5794974 | 0.86 | TP53 (0.47) | TP53HTR6ALDH1A1TSHRKDM4E | |
| SCHEMBL1748616 | 0.83 | TP53 (0.39) | TP53HTR6CYP3A4CYP2D6ALDH1A1 | |
| SCHEMBL5795298 | 0.82 | HTR6 (0.47) | TP53HTR6CYP3A4CYP2D6ALDH1A1 | |
| SCHEMBL1748689 | 0.81 | TP53 (0.39) | TP53HTR6ALDH1A1TSHRKDM4E | |
| SCHEMBL5794570 | 0.80 | TP53 (0.41) | TP53HTR6ALDH1A1KDM4EMEN1 | |
| SCHEMBL1748859 | 0.76 | KIT (0.39) | TP53ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL5821747 | 0.76 | HTR6 (0.44) | TP53HTR6CYP3A4CYP2D6KMT2A | |
| SCHEMBL1748871 | 0.75 | KIT (0.40) | TP53ALDH1A1KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1732546-A2 | NOVEL PYRROLO (2,3-B)PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS | Aventis Pharma S.A. (FR) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005095399-A2 | NOVEL PYRROLO (2,3-B)PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS | AVENTIS PHARMA S.A. (FR) | 2005-10-13 | — | — | WO | disclosed |