Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 4/20 | 0.38 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.38 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | IL6 | P05231 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 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 | |
|---|---|---|---|---|
| SCHEMBL11845156 | 0.80 | TAS2R14 (0.41) | TAS2R14NFKB1LMNATNFIL6 | |
| SCHEMBL15428022 | 0.80 | LMNA (0.41) | LMNAMEN1THRBBLMKMT2A | |
| SCHEMBL6853771 | 0.79 | NFKB1 (0.44) | PIM1PIM3NFKB1LMNAMEN1 | |
| SCHEMBL29417728 | 0.79 | NFKB1 (0.57) | PIM1PIM3NFKB1LMNAMEN1 | |
| SCHEMBL67207 | 0.79 | NFKB1 (0.57) | PIM1PIM3NFKB1LMNAMEN1 | |
| SCHEMBL1232196 | 0.78 | LMNA (0.58) | LMNAMEN1THRBBLMKMT2A | |
| SCHEMBL1041748 | 0.78 | TAS2R14 (0.46) | TAS2R14LMNATDP1GAA | |
| SCHEMBL1600817 | 0.78 | PIM1 (0.43) | PIM1PIM3NFKB1LMNAMEN1 | |
| SCHEMBL622545 | 0.78 | ERN1 (0.44) | PIM1PIM3NFKB1LMNAMEN1 | |
| SCHEMBL6854167 | 0.78 | NFKB1 (0.47) | PIM1PIM3NFKB1LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3212643-A1 | TRIFLUOROMETHYL ALCOHOLS AS MODULATORS OF RORyt | Janssen Pharmaceutica, N.V. (BE) | 2017-09-06 | — | — | EP | disclosed |
| WO-2016069974-A1 | TRIFLUOROMETHYL ALCOHOLS AS MODULATORS OF RORyt | JANSSEN PHARMACEUTICA NV (BE) | 2016-05-06 | — | — | WO | disclosed |