Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | NOS2 | P35228 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | LTK | P29376 | 1/20 | 0.46 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.46 |
| ▸ | CLK2 | P49760 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20101033 | 0.89 | KDM4E (0.58) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL10289446 | 0.81 | KDM4E (0.52) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL2564755 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL2564746 | 0.81 | NOS3 (0.51) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL25203872 | 0.79 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL15267189 | 0.78 | KDM4E (0.58) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL1195267 | 0.75 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL25241674 | 0.75 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL25224389 | 0.75 | MAPT (0.51) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A | |
| SCHEMBL15279086 | 0.74 | KDM4E (0.48) | ALDH1A1SMN1; SMN2LMNAHTTRAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102026985-A | Quinazoline derivatives as RAF kinase modulators and methods and uses thereof | AMBIT BIOSCIENCES CORPORATON | 2011-04-20 | — | — | CN | disclosed |
| WO-2010076525-A1 | DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2010-07-08 | — | — | WO | disclosed |
| WO-2010076524-A2 | DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS | SANOFI-AVENTIS (FR) | 2010-07-08 | — | — | WO | disclosed |