Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.44 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10546863 | 0.88 | NPC1 (0.45) | THRBHTTMAPK14LMNAMAPT | |
| SCHEMBL10548932 | 0.87 | THRB (0.46) | THRBTSHRMAPK1HTTMAPK14 | |
| SCHEMBL10757185 | 0.81 | CSNK2A1 (0.47) | HTTMAP2K2MAP2K1LMNAMAPT | |
| SCHEMBL10467490 | 0.79 | KDM4E (0.48) | TSHRMAPTNPC1ALDH1A1HPGD | |
| SCHEMBL10550001 | 0.79 | THRB (0.44) | THRBHTTMAPK14LMNAMAPT | |
| SCHEMBL10469421 | 0.78 | KDM4E (0.43) | TSHRLMNASMN1; SMN2ALDH1A1GAA | |
| SCHEMBL10547734 | 0.77 | THRB (0.45) | THRBTSHRMAPK14LMNAMAPT | |
| SCHEMBL10467363 | 0.76 | ALDH1A1 (0.47) | TSHRMAPK1HTTLMNAMAPT | |
| SCHEMBL10549993 | 0.76 | NPC1 (0.43) | THRBHTTLMNAMAPTSMN1; SMN2 | |
| SCHEMBL10548728 | 0.76 | THRB (0.44) | THRBTSHRMAPK14MAPTSMN1; SMN2 |
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-4851535-A | 2-(5-FLUORONICOTINOYL)ACETIC ACID DERIVATIVES, ANTIBACTERIAL 1-ARYL-1,4-DIHYDRO-4-OXONAPHTHYRIDINES | TOYAMA CHEMICAL CO., LTD. (JP) | 1989-07-25 | — | — | US | disclosed |
| US-4704459-A | VILSMEIER REAGENT | TOYAMA CHEMICAL CO., LTD. (JP) | 1987-11-03 | — | — | US | disclosed |