Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | GFER | P55789 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL12711276 | 0.89 | KDR (0.33) | KDRDRD2HTR2AHTR2CDRD3 | |
| SCHEMBL12711352 | 0.87 | KDR (0.32) | KDRDRD2HTR2AHTR2CDRD3 | |
| SCHEMBL12711506 | 0.83 | KDR (0.31) | KDRDRD2HTR2AHTR2CDRD3 | |
| SCHEMBL16546082 | 0.80 | NPC1 (0.32) | NPC1MAPT | |
| SCHEMBL16546096 | 0.79 | — | — | |
| SCHEMBL17122402 | 0.78 | ESR1 (0.39) | ALDH1A1MAPT | |
| SCHEMBL16546087 | 0.76 | ADORA1 (0.37) | KDRNPC1ALDH1A1MAPT | |
| SCHEMBL16546095 | 0.76 | — | — | |
| SCHEMBL16546079 | 0.74 | HSD17B1 (0.41) | NPC1ALDH1A1MAPT | |
| SCHEMBL12711280 | 0.73 | KDR (0.32) | KDRNPC1ALDH1A1MAPTGFER |
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-9147843-B2 | Organic semiconductor material | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-09-29 | — | — | US | disclosed |
| US-20150065671-A1 | ORGANIC SEMICONDUCTOR MATERIAL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-03-05 | — | — | US | disclosed |