Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | AKT2 | P31751 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 3/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | BRD2 | P25440 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14964006 | 0.89 | MAP3K8 (0.36) | ALDH1A1PKMMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL14964010 | 0.87 | MAP3K8 (0.35) | ALDH1A1PKMMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL14964015 | 0.85 | ACHE (0.39) | ALDH1A1ACHENPSR1MAPTKDM4E | |
| SCHEMBL14964020 | 0.84 | GSTP1 (0.42) | ACHEMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL14964009 | 0.84 | DHFR (0.39) | ALDH1A1MAPTKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL18100476 | 0.83 | NEK1 (0.35) | ALDH1A1ACHEPKMRXFP1NPSR1 | |
| SCHEMBL14964012 | 0.82 | L3MBTL1 (0.48) | ALDH1A1RXFP1NPSR1MAPTKDM4E | |
| SCHEMBL1102369 | 0.81 | NPC1 (0.35) | CHEK1AKT2ALDH1A1PKMMAPT | |
| SCHEMBL25450806 | 0.80 | PTGS2 (0.43) | CHEK1AKT2ALDH1A1PKMMAPT | |
| SCHEMBL14964011 | 0.80 | IKBKB (0.43) | ALDH1A1NPSR1MAPTKDM4ESMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9394406-B2 | Polymers containing substituted benzodithiophene units, blends comprising these polymers, and devices comprising these polymers or blends | MERCK PATENT GMBH (DE) | 2016-07-19 | — | — | US | disclosed |
| US-20130126855-A1 | POLYMERS CONTAINING SUBSTITUTED BENZODITHIOPHENE UNITS, BLENDS COMPRISING THESE POLYMERS, AND DEVICES COMPRISING THESE POLYMERS OR BLENDS | MERCK PATENT GMBH (DE) | 2013-05-23 | — | — | US | disclosed |