Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CASP2 | P42575 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | F13A1 | P00488 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.37 |
| ▸ | CA6 | P23280 | 2/20 | 0.37 |
| ▸ | CA5A | P35218 | 2/20 | 0.37 |
| ▸ | THPO | P40225 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4386775 | 0.81 | CA12 (0.46) | TDP1CASP2CA12F13A1CA2 | |
| SCHEMBL1948509 | 0.78 | SLC6A4 (0.41) | SLC6A4 | |
| SCHEMBL16260099 | 0.77 | CA12 (0.48) | TDP1CASP2CA12F13A1CA2 | |
| Hydrochloric Acid SCHEMBL23023659 | 0.77 | SLC6A4 (0.40) | SLC6A4 | |
| Hydrochloric Acid SCHEMBL23023658 | 0.77 | SLC6A4 (0.40) | SLC6A4 | |
| SCHEMBL9943430 | 0.76 | CA12 (0.41) | TDP1CASP2CA12F13A1CA2 | |
| SCHEMBL11277100 | 0.76 | SLC6A4 (0.37) | SLC6A4 | |
| SCHEMBL246857 | 0.74 | — | — | |
| SCHEMBL3432832 | 0.74 | — | — | |
| SCHEMBL11277200 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1077922-B1 | POLYAMINE | KAO CORP (JP) | 2004-02-18 | — | — | EP | disclosed |
| US-6667382-B1 | Straight chain aliphatic amine salt with primary, secondary and tertiary functionality; workability; emulsifying quick setting asphalt | KAO CORPORATION (JP) | 2003-12-23 | — | — | US | disclosed |