Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27361572 | 0.86 | RAB9A (0.44) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27359800 | 0.86 | MEN1 (0.43) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27400434 | 0.83 | KDM4E (0.43) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27380600 | 0.83 | RAB9A (0.40) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27359801 | 0.83 | RAB9A (0.48) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27379175 | 0.81 | SMN1; SMN2 (0.43) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27376733 | 0.81 | AOC3 (0.41) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27363569 | 0.80 | LMNA (0.36) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL27379146 | 0.78 | LMNA (0.44) | LMNACYP1A2CYP2D6CYP2C19BCHE | |
| SCHEMBL27360419 | 0.77 | LMNA (0.39) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1069882-A | The Compounds and methods for that suppresses HIV and correlated virus | MEDIVIR AB (CH) | 1993-03-17 | — | — | CN | disclosed |