Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | POLA1 | P09884 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28625986 | 0.90 | TSHR (0.48) | TSHRCA12CA14KMT2AMEN1 | |
| SCHEMBL28718243 | 0.88 | CYP4F2 (0.38) | TSHRKMT2AMEN1LMNACYP4F2 | |
| SCHEMBL17617116 | 0.84 | CYP4F2 (0.42) | TSHRKMT2AMEN1LMNACYP4F2 | |
| SCHEMBL15295458 | 0.81 | CYP4F2 (0.42) | CA12CA14KMT2AMEN1LMNA | |
| SCHEMBL9141375 | 0.80 | DGAT1 (0.36) | TSHRKMT2AMEN1LMNACA2 | |
| SCHEMBL2116492 | 0.79 | TSHR (0.52) | TSHRCA12CA14KMT2AMEN1 | |
| SCHEMBL18597562 | 0.79 | CYP4F2 (0.39) | LMNAKDM4ECYP4F2CYP4A11ALDH1A1 | |
| SCHEMBL2989525 | 0.78 | TSHR (0.43) | TSHRCA12CA14KMT2AMEN1 | |
| SCHEMBL15292172 | 0.77 | CYP4F2 (0.34) | LMNACYP4F2CYP4A11HSD17B10 | |
| SCHEMBL14890680 | 0.76 | TSHR (0.48) | TSHRCA12CA14KMT2ALMNA |
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-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |