Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3371408 | 0.86 | LMNA (0.38) | TSHRHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3370054 | 0.83 | TSHR (0.34) | TSHRSMN1; SMN2MGAMMAPTMAPK1 | |
| SCHEMBL3371422 | 0.82 | TSHR (0.37) | TSHRSMN1; SMN2HTTMAPTMAPK1 | |
| SCHEMBL3371456 | 0.79 | NPC1 (0.52) | TSHRHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3371781 | 0.78 | MGAM (0.36) | TSHRHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3368328 | 0.76 | TSHR (0.49) | TSHRLMNAALDH1A1CYP2C9CYP3A4 | |
| SCHEMBL3368343 | 0.75 | EGLN1 (0.45) | TSHRHSD17B10SMN1; SMN2MGAMHTT | |
| SCHEMBL2070164 | 0.74 | MAPT (0.58) | TSHRHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3398353 | 0.74 | TP53 (0.33) | TSHRSMN1; SMN2NPC1RAB9AMGAM | |
| SCHEMBL3371414 | 0.72 | PTPN1 (0.35) | TSHRMGAMALDH1A1HCAR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010018458-A2 | PHENOL DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2010-02-18 | — | — | WO | claimed |
| WO-2010018458-A2 | PHENOL DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2010-02-18 | — | — | WO | disclosed |