Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16302152 | 0.89 | RAB9A (0.49) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL16302157 | 0.80 | RAB9A (0.50) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL850322 | 0.79 | ALDH1A1 (0.54) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL848274 | 0.76 | RAB9A (0.47) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL8292659 | 0.76 | RAB9A (0.53) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL849767 | 0.74 | RAB9A (0.48) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL16357874 | 0.72 | MAPT (0.44) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL848671 | 0.71 | HTT (0.50) | ALDH1A1RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL6376391 | 0.71 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2933227 | 0.71 | ALDH1A1 (0.58) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010126030-A1 | SPIROIMIDAZOLONE DERIVATIVE | 中外製薬株式会社 (JP) | 2010-11-04 | — | — | WO | disclosed |