Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9511015 | 1.00 | TSHR (0.38) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL10985252 | 0.78 | TSHR (0.52) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL11124168 | 0.76 | TSHR (0.50) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL10595994 | 0.75 | TSHR (0.48) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL11589229 | 0.75 | — | — | |
| SCHEMBL10796440 | 0.72 | ALDH1A1 (0.41) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL10710731 | 0.69 | TSHR (0.65) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL27797744 | 0.69 | TSHR (0.39) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL28909297 | 0.69 | TSHR (0.39) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| SCHEMBL10902668 | 0.69 | TSHR (0.52) | TSHRALDH1A1TDP1GRIN2DGRIN3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0399293-B1 | PROCESS FOR PREPARING 2-CHLORO-4-NITRO-ALKYLBENZENE | BAYER AG (DE) | 1993-09-01 | — | — | EP | disclosed |
| US-5095157-A | Friedel-crafts catalyst | BAYER AKTIENGESELLSCHAFT (DE) | 1992-03-10 | — | — | US | disclosed |
| EP-0399293-A1 | Process for preparing 2-chloro-4-nitro-alkylbenzene | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |