Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10881672 | 0.83 | TSHR (0.41) | TSHRCYP1A2ALDH1A1PTPN1CA1 | |
| SCHEMBL6522927 | 0.82 | TSHR (0.44) | TSHRCYP1A2ALDH1A1PTPN1CA1 | |
| SCHEMBL1568686 | 0.82 | TSHR (0.44) | TSHRCYP1A2ALDH1A1PTPN1CA1 | |
| SCHEMBL11761677 | 0.80 | CYP3A4 (0.38) | TSHRCYP1A2 | |
| SCHEMBL11257453 | 0.78 | TSHR (0.41) | TSHRCYP1A2ALDH1A1KCNN4MAPT | |
| SCHEMBL10942927 | 0.78 | TSHR (0.31) | TSHRCYP1A2 | |
| SCHEMBL27686357 | 0.77 | TSHR (0.44) | TSHRCYP1A2ALDH1A1PTPN1CA1 | |
| SCHEMBL1149592 | 0.76 | KCNN4 (0.36) | TSHRCYP1A2ALDH1A1PTPN1CA1 | |
| SCHEMBL129231 | 0.76 | KCNN4 (0.36) | TSHRCYP1A2ALDH1A1PTPN1CA1 | |
| SCHEMBL15413 | 0.76 | KCNN4 (0.36) | TSHRCYP1A2ALDH1A1PTPN1CA1 |
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-3965074-A | Homopolymers of polyfluorinated vinyl isocyanates | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-06-22 | — | — | US | disclosed |
| US-3943112-A | PERFLUORINATED VINYL ISOCYANATE COPOLYMERS; OIL AND WATER REPELLENTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-03-09 | — | — | US | disclosed |