Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| Aniline SCHEMBL7809682 | 0.85 | TSHR (0.44) | MAPTMEN1KMT2ARAB9ATDP1 | |
| SCHEMBL11690323 | 0.77 | ALDH1A1 (0.42) | MAPTMEN1KMT2ARAB9ATDP1 | |
| SCHEMBL8744002 | 0.77 | NPC1 (0.39) | MAPTMEN1KMT2AL3MBTL1RAB9A | |
| SCHEMBL3921739 | 0.77 | TSHR (0.40) | TDP1ALDH1A1TSHRCYP3A4CASP1 | |
| SCHEMBL8744066 | 0.77 | S100B (0.39) | MAPTMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL8744025 | 0.77 | KDM4E (0.46) | MAPTKMT2ARAB9ANPC1KDM4E | |
| SCHEMBL570653 | 0.76 | MEN1 (0.41) | MAPTMEN1KMT2AL3MBTL1RAB9A | |
| SCHEMBL8921861 | 0.75 | NOS1 (0.44) | TDP1KDM4EALDH1A1NOS1RECQL | |
| SCHEMBL9359959 | 0.74 | ALDH1A1 (0.39) | MAPTMEN1KMT2ARAB9ATDP1 | |
| SCHEMBL17053451 | 0.73 | ALDH1A1 (0.41) | MAPTMEN1KMT2AL3MBTL1RAB9A |
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-5618980-A | DEHYDROGENATING N-CYCLOHEXYLIDENEAMINO COMPOUND IN PRESENCE OF HYDROGEN TRANSFER CATALYST AND HYDROGEN ACCEPTOR AND ALKALI OR ALKALINE EARTH METAL COMPOUND COCATALYST | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-04-08 | — | — | US | disclosed |
| US-5536878-A | HYDROGEN ACCEPTOR | MITSUI TOATSU CHEMICALS, INC. (JP) | 1996-07-16 | — | — | US | disclosed |