Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | COMT | P21964 | 2/20 | 0.38 |
| ▸ | TRPC5 | Q9UL62 | 7/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 3/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | TEC | P42680 | 1/20 | 0.34 |
| ▸ | TXK | P42681 | 1/20 | 0.34 |
| ▸ | BLK | P51451 | 1/20 | 0.34 |
| ▸ | BMX | P51813 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | ITK | Q08881 | 1/20 | 0.34 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27804070 | 0.82 | KMT2A (0.49) | MAPK1KMT2ACOMTALDH1A1HTT | |
| SCHEMBL28786528 | 0.81 | LMNA (0.45) | TRPC5ALDH1A1F10 | |
| SCHEMBL27824924 | 0.77 | F10 (0.36) | MAPK1KMT2ABTKP2RX7F10 | |
| SCHEMBL3396051 | 0.76 | MAPK1 (0.51) | MAPK1KMT2ACOMTTRPC5KDM4E | |
| SCHEMBL3398174 | 0.76 | MAPK1 (0.56) | MAPK1KMT2ACOMTACHERAD52 | |
| SCHEMBL3400888 | 0.74 | KMT2A (0.54) | MAPK1KMT2AALDH1A1P2RX7 | |
| SCHEMBL27915874 | 0.74 | MAPK1 (0.54) | MAPK1KMT2ATRPC5KDM4EALDH1A1 | |
| SCHEMBL28237788 | 0.71 | GFER (0.41) | KMT2AKDM4EALDH1A1HPGDHTT | |
| SCHEMBL27824915 | 0.71 | NR1H2 (0.46) | MAPK1KMT2ACOMTALDH1A1ACHE | |
| SCHEMBL31203025 | 0.70 | MAPK1 (0.52) | MAPK1KMT2ATRPC5BTKP2RX7 |
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-101981036-A | Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors | NOVARTIS AG | 2011-02-23 | — | — | CN | disclosed |