Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | ACP3 | P15309 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | GRM8 | O00222 | 4/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 4/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | GRM6 | O15303 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2015079 | 0.85 | TSHR (0.53) | TSHRLMNAALDH1A1ACP3MAPT | |
| Hydrochloric Acid SCHEMBL7062633 | 0.83 | TSHR (0.52) | TSHRLMNAALDH1A1ACP3MAPT | |
| SCHEMBL16954911 | 0.83 | TSHR (0.55) | TSHRLMNAALDH1A1ACP3MAPT | |
| SCHEMBL10429545 | 0.81 | TDP1 (0.39) | TSHRLMNAALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL2121190 | 0.80 | TSHR (0.61) | TSHRLMNAALDH1A1ACP3MAPT | |
| SCHEMBL9300709 | 0.79 | ALDH1A1 (0.47) | TSHRLMNAALDH1A1MAPTACHE | |
| SCHEMBL11044208 | 0.79 | TSHR (0.50) | TSHRLMNAALDH1A1ACP3MAPT | |
| SCHEMBL21634465 | 0.79 | ACP3 (0.54) | TSHRLMNAALDH1A1ACP3MAPT | |
| SCHEMBL9256933 | 0.78 | DPP4 (0.36) | — | |
| SCHEMBL6359586 | 0.77 | TSHR (0.57) | TSHRLMNAALDH1A1ACP3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| JP-6065166-A | — | — | None | — | — | JP | disclosed |
| JP-H0665166-A | SEPARATION OF ALPHA-@(3754/24)M-NITROPHENYL)ALKYLAMINE AND ALPHA-@(3754/24)P-NITROPHENYL)ALKYLAMINE AND PRODUCTION OF ALPHA-@(3754/24)M-AMINOPHENYL)ALKYLAMINE AND ALPHA-@(3754/24)P-AMINOPHENYL) ALKYLAMINES USING THE SAME | MITSUI TOATSU CHEM INC | 1994-03-08 | — | — | JP | disclosed |