Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 0.32 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.31 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18934671 | 0.89 | TDP1 (0.50) | TDP1ATMALDH1A1HIF1ACA1 | |
| SCHEMBL19241443 | 0.80 | KEAP1 (0.40) | TDP1ATMALDH1A1HIF1ACA1 | |
| SCHEMBL17347338 | 0.77 | ATM (0.65) | TDP1ATMALDH1A1 | |
| SCHEMBL13066127 | 0.75 | TSHR (0.39) | TDP1ATMALDH1A1 | |
| SCHEMBL17145919 | 0.74 | MAPK1 (0.41) | ALDH1A1HIF1AVCAM1MEN1POLB | |
| SCHEMBL15114333 | 0.71 | TSHR (0.38) | ALDH1A1KDM4E | |
| SCHEMBL13076923 | 0.69 | EPAS1 (0.40) | TDP1ALDH1A1HIF1AKDM4EMEN1 | |
| SCHEMBL16474073 | 0.69 | CES2 (0.41) | TDP1ATMALDH1A1HIF1ACA1 | |
| SCHEMBL1858469 | 0.68 | ALDH1A1 (0.35) | ALDH1A1HIF1ACA1VCAM1 | |
| SCHEMBL14008592 | 0.68 | VCAM1 (0.53) | ALDH1A1VCAM1LMNAMAPT |
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-2017093958-A1 | BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLE DERIVATIVES FOR ORGANIC LIGHT EMITTING DIODES | IDEMITSU KOSAN CO., LTD. (JP) | 2017-06-08 | — | — | WO | disclosed |