Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 1/20 | 0.52 |
| ▸ | MPL | P40238 | 3/20 | 0.47 |
| ▸ | CTRC | Q99895 | 2/20 | 0.47 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.44 |
| ▸ | KDM4A | O75164 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | NSD2 | O96028 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.44 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.44 |
| ▸ | MMP14 | P50281 | 1/20 | 0.44 |
| ▸ | CASP6 | P55212 | 1/20 | 0.44 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4360130 | 0.82 | CA1 (0.50) | CTRB1MPLCTRCHCRTR1CA1 | |
| SCHEMBL28210690 | 0.81 | CTRB1 (0.47) | CTRB1MPLCTRCCYP2D6HCRTR1 | |
| SCHEMBL30383446 | 0.80 | CTRB1 (0.64) | CTRB1MPLCTRCPTPN22LDHA | |
| Hydrochloric Acid SCHEMBL27766336 | 0.80 | CTRB1 (0.64) | CTRB1MPLCTRCPTPN22LDHA | |
| SCHEMBL88069 | 0.80 | CTRB1 (0.64) | CTRB1MPLCTRCPTPN22LDHA | |
| SCHEMBL29401627 | 0.80 | PTPN22 (0.65) | PTPN22USP2LDHACYP2D6CYP1A2 | |
| SCHEMBL374807 | 0.80 | PTPN22 (0.65) | PTPN22USP2LDHACYP2D6CYP1A2 | |
| Potassium SCHEMBL2292044 | 0.79 | CTRB1 (0.62) | CTRB1MPLCTRCPTPN22LDHA | |
| SCHEMBL7158072 | 0.79 | CTRB1 (0.62) | CTRB1MPLCTRCPTPN22LDHA | |
| Ammonia Solution, Strong SCHEMBL7758965 | 0.79 | CTRB1 (0.62) | CTRB1MPLCTRCPTPN22LDHA |
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-5128455-A | WATER-SOLUBLE FIBER-REACTIVE DYES, CONTAINING AN AMINO-SUBSTITUTED 5-TRIAZINE RING WITH A FIBER-REACTIVE GROUP OF THE VINYLSULFONE SERIES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-07-07 | — | — | US | disclosed |