Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | POLB | P06746 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | RGS12 | O14924 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2781437 | 0.84 | ALDH1A1 (0.63) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| Hydrochloric Acid SCHEMBL27517470 | 0.82 | ALDH1A1 (0.61) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| SCHEMBL8404953 | 0.79 | ALDH1A1 (0.50) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| SCHEMBL4296331 | 0.78 | NPC1 (0.46) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| SCHEMBL28618700 | 0.78 | ALDH1A1 (0.52) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| SCHEMBL9444664 | 0.77 | PTGDR2 (0.52) | ALDH1A1NPC1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL10353760 | 0.76 | L3MBTL1 (0.52) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| SCHEMBL9444684 | 0.76 | ALOX15 (0.50) | ALDH1A1POLBKMT2AESR1MEN1 | |
| SCHEMBL2203788 | 0.75 | KMT2A (0.52) | ALDH1A1POLBKMT2ANPSR1NPC1 | |
| SCHEMBL28157600 | 0.75 | KDM4E (0.44) | ALDH1A1POLBKMT2AMEN1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0333522-B1 | Catechol derivatives and pharmaceutical preparations containing same | MITSUI TOATSU CHEMICALS (JP) | 1994-08-17 | — | — | EP | disclosed |
| US-5232923-A | Stimulates production of nerve growth factor; administering for treatment of regressive disorders of the central nervous system | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1993-08-03 | — | — | US | disclosed |
| EP-0333522-A2 | Catechol derivatives and pharmaceutical preparations containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1989-09-20 | — | — | EP | disclosed |