Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18242152 | 0.82 | CYP2A6 (0.44) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL9466601 | 0.82 | ALDH1A1 (0.44) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL1706021 | 0.80 | CYP1A2 (0.52) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL7254708 | 0.78 | ERN1 (0.60) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL1613222 | 0.77 | NR1I2 (0.47) | TSHRALDH1A1HSD17B10CYP2A6L3MBTL1 | |
| SCHEMBL8375753 | 0.76 | KDM4E (0.61) | ALDH1A1TDP1L3MBTL1GAANPC1 | |
| SCHEMBL5010129 | 0.76 | L3MBTL1 (0.39) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL5010151 | 0.73 | CYP2A6 (0.42) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL5008784 | 0.72 | DNMT1 (0.38) | TSHRALDH1A1TDP1HSD17B10CYP2A6 | |
| SCHEMBL7801282 | 0.72 | ALDH1A1 (0.51) | TSHRALDH1A1TDP1L3MBTL1GAA |
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-6005116-A | HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA | SANKYO COMPANY, LIMITED (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |