Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 6/20 | 0.60 |
| ▸ | CTSL | P07711 | 5/20 | 0.55 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.55 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.52 |
| ▸ | CDK2 | P24941 | 2/20 | 0.52 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.52 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.52 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.52 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL17450223 | 0.88 | CDK1 (0.60) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL17450142 | 0.87 | CTSL (0.67) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL17450224 | 0.87 | CDK1 (0.57) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL17450179 | 0.86 | CDK1 (0.56) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL17450124 | 0.85 | CDK1 (0.72) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL20350685 | 0.85 | CDK1 (0.73) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL17442999 | 0.85 | CDK1 (0.73) | CDK1CDK5KDM4ENPC1MAPT | |
| SCHEMBL17450131 | 0.82 | CTSL (0.72) | CDK1CTSLCDK2YTHDC1 | |
| SCHEMBL21609988 | 0.81 | CDK1 (0.53) | CDK1CTSLTMIGD3ADORA2AADORA1 | |
| SCHEMBL3851604 | 0.81 | TDP1 (0.78) | CDK1CDK5KDM4ENPC1MAPT |
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-2016011394-A1 | IMAGING AGENTS FOR NEURAL FLUX | THE GENERAL HOSPITAL CORPORATION (US) | 2016-01-21 | — | — | WO | disclosed |