Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5991 | 0.86 | — | — | |
| SCHEMBL27259142 | 0.86 | TSHR (0.50) | TSHRTDP1CA2USP2CA1 | |
| SCHEMBL27308161 | 0.86 | TSHR (0.50) | TSHRTDP1CA2USP2CA1 | |
| SCHEMBL27346657 | 0.86 | TSHR (0.50) | TSHRTDP1CA2USP2CA1 | |
| Bromide SCHEMBL2124260 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL7529877 | 0.82 | TSHR (0.47) | TSHRTDP1CA2USP2CA1 | |
| SCHEMBL8758797 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL60731 | 0.82 | — | — | |
| Water SCHEMBL3365863 | 0.82 | — | — | |
| Methane SCHEMBL472929 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0548616-A1 | Aqueous chemiluminescent systems | AMERICAN CYANAMID COMPANY (US) | 1993-06-30 | — | — | EP | disclosed |