Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29375147 | 0.88 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTDP1HSD17B10 | |
| SCHEMBL64099 | 0.88 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTDP1HSD17B10 | |
| SCHEMBL9161948 | 0.86 | ALDH1A1 (0.55) | CASP1ALDH1A1CYP3A4TSHRTDP1 | |
| Hydrochloric Acid SCHEMBL10782973 | 0.86 | ALDH1A1 (0.65) | ALDH1A1CYP3A4TSHRTDP1HSD17B10 | |
| Hydrochloric Acid SCHEMBL10782376 | 0.86 | ALDH1A1 (0.65) | ALDH1A1CYP3A4TSHRTDP1HSD17B10 | |
| SCHEMBL264325 | 0.81 | MAPT (0.57) | CASP1ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL29354063 | 0.81 | — | — | |
| SCHEMBL5956120 | 0.81 | CASP1 (1.00) | CASP1ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL15010 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL7132403 | 0.79 | CASP1 (0.94) | CASP1ALDH1A1CYP3A4TSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5231172-A | Water solubility | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-07-27 | — | — | US | disclosed |