Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL11671374 | 0.91 | CYP3A4 (0.38) | ALDH1A1TSHRLMNAMAPTTDP1 | |
| SCHEMBL11678038 | 0.82 | MAPK1 (0.35) | ALDH1A1TSHRSMN1; SMN2MAPK1LMNA | |
| SCHEMBL11671662 | 0.81 | TSPO (0.47) | LMNAMAPT | |
| SCHEMBL11671865 | 0.81 | ESR1 (0.39) | TSHRSMN1; SMN2MTNR1AMTNR1BMEN1 | |
| SCHEMBL11671701 | 0.80 | TDP1 (0.42) | ALDH1A1TSHRSMN1; SMN2LMNAMAPT | |
| SCHEMBL11699625 | 0.80 | MTNR1A (0.37) | TSHRLMNATDP1MTNR1AMTNR1B | |
| SCHEMBL11671571 | 0.80 | HSD17B10 (0.45) | ALDH1A1TSHRSMN1; SMN2MAPK1LMNA | |
| Hydrochloric Acid SCHEMBL11671225 | 0.79 | TDP1 (0.41) | ALDH1A1TSHRSMN1; SMN2LMNAMAPT | |
| SCHEMBL11670389 | 0.78 | POLB (0.39) | ALDH1A1TSHRMAPK1LMNAMAPT | |
| SCHEMBL11671871 | 0.78 | MAPT (0.42) | ALDH1A1MAPK1LMNAMAPTMTNR1A |
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-4039526-A | PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-08-02 | — | — | US | disclosed |
| US-4039539-A | 1,2,4-Triazole-azo-aniline cationic dyestuffs | BAYER AKTIENGESELLSCHAFT (DT) | 1977-08-02 | — | — | US | disclosed |