Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3437003 | 0.89 | ALDH1A1 (0.66) | ALDH1A1TSHRMAPK10CYP1A2CYP2C19 | |
| SCHEMBL7087626 | 0.87 | PDE4B (0.57) | ALDH1A1TSHRMAPK10EPHX2POLB | |
| SCHEMBL8579115 | 0.84 | NPC1 (0.55) | ALDH1A1MEN1KMT2AGAAPKM | |
| SCHEMBL13074346 | 0.82 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK10CYP1A2CYP2C19 | |
| SCHEMBL3369076 | 0.79 | KMT2A (0.63) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL31619840 | 0.79 | KMT2A (0.63) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL14684322 | 0.78 | ALDH1A1 (0.84) | ALDH1A1TSHRMAPK10CYP1A2CYP2C19 | |
| SCHEMBL14676952 | 0.77 | ALDH1A1 (0.67) | ALDH1A1TSHRMAPK10CYP1A2CYP2C19 | |
| SCHEMBL16480196 | 0.76 | ALDH1A1 (0.88) | ALDH1A1TSHRMAPK10CYP1A2CYP2C19 | |
| SCHEMBL4481359 | 0.76 | CYP1A2 (0.62) | ALDH1A1TSHRCYP1A2CYP2C19MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6248746-B1 | PHOSPHODIESTERASE (PDE-IV) INHIBITOR FOR TREATMENT OF ASTHMA, ALLERGIES, ATOPIC DISEASES AND RHINITIS | EURO-CELTIQUE S.A. (LU) | 2001-06-19 | — | — | US | disclosed |