Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9867170 | 0.99 | ALDH1A1 (0.38) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9866166 | 0.95 | ALDH1A1 (0.36) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9866983 | 0.89 | ADORA2A (0.33) | ALDH1A1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9867208 | 0.83 | SIGMAR1 (0.34) | ALDH1A1KDM4EHRH4HRH3SIGMAR1 | |
| SCHEMBL8367322 | 0.81 | ADORA2A (0.36) | ALDH1A1SMN1; SMN2POLBKMT2A | |
| SCHEMBL9866875 | 0.80 | ADORA2A (0.34) | ALDH1A1HRH3POLBKMT2A | |
| Hydrochloric Acid SCHEMBL8151433 | 0.80 | TLR8 (0.36) | ALDH1A1POLBKMT2A | |
| SCHEMBL9866891 | 0.78 | KDM4E (0.31) | ALDH1A1KDM4E | |
| SCHEMBL9866879 | 0.77 | ALDH1A1 (0.42) | ALDH1A1KDM4ECYP2D6CYP2C19HRH3 | |
| SCHEMBL13587988 | 0.77 | TLR8 (0.39) | ALDH1A1POLBKMT2A |
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-5011838-A | Antiallergens, antihistamines | DOMPE FARMACEUTICI S.P.A. (IT) | 1991-04-30 | — | — | US | disclosed |
| EP-0397615-A2 | Pharmacologically active 2-substituted 3-(2-ethoxyethyl) imidazo [4,5-b] pyridines and pharmaceutical compositions containing them | DOMPE' FARMACEUTICI S.p.A. (IT) | 1990-11-14 | — | — | EP | disclosed |