Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 14/20 | 0.48 |
| ▸ | CA1 | P00915 | 13/20 | 0.48 |
| ▸ | CA9 | Q16790 | 10/20 | 0.48 |
| ▸ | CA12 | O43570 | 9/20 | 0.48 |
| ▸ | CA4 | P22748 | 7/20 | 0.48 |
| ▸ | CA6 | P23280 | 6/20 | 0.48 |
| ▸ | CA5A | P35218 | 6/20 | 0.48 |
| ▸ | CA7 | P43166 | 6/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 6/20 | 0.48 |
| ▸ | CA3 | P07451 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | APEX1 | P27695 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11331506 | 0.81 | CA2 (0.44) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11329189 | 0.81 | CA2 (0.44) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11335802 | 0.80 | CA1 (0.41) | CA2CA1CA9CA12CA4 | |
| SCHEMBL1806519 | 0.78 | CA1 (0.76) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11122869 | 0.76 | CA2 (0.49) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11519211 | 0.76 | THRB (0.43) | CA2CA1CA9CA12CA4 | |
| SCHEMBL1035731 | 0.74 | GAA (0.55) | CA2CA1CA9CA12CA4 | |
| SCHEMBL29447759 | 0.74 | GAA (0.55) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11324354 | 0.73 | CA2 (0.50) | CA2CA1CA9CA12CA4 | |
| SCHEMBL11325818 | 0.73 | CA2 (0.65) | CA2CA1CA9CA12CA4 |
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-4243584-A | Monoazo dyestuffs containing diazo component substituted by disulfimide and trifluoromethyl groups | BAYER AKTIENGESELLSCHAFT (DE) | 1981-01-06 | — | — | US | disclosed |
| US-4159265-A | Phenylazopyrazolo dyestuffs including disulfimide substituent | BAYER AKTIENGESELLSCHAFT (DE) | 1979-06-26 | — | — | US | disclosed |