Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | NQO1 | P15559 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27699860 | 0.89 | NPC1 (0.48) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL18150080 | 0.88 | TP53 (0.49) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL18154548 | 0.85 | NQO1 (0.50) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL18150087 | 0.81 | BRAF (0.53) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL28455189 | 0.77 | ALDH1A1 (0.47) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL1800595 | 0.77 | CA1 (0.56) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL9311 | 0.76 | CA1 (0.56) | ALDH1A1TP53LMNACYP3A4MAPK1 | |
| SCHEMBL28053823 | 0.76 | CA1 (0.51) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL27594102 | 0.72 | MAOA (0.50) | ALDH1A1NQO1TP53LMNACYP3A4 | |
| SCHEMBL28859670 | 0.72 | CA1 (0.51) | ALDH1A1NQO1TP53LMNACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3283481-A1 | CHROMENE DERIVATIVES AS PHOSHOINOSITIDE 3-KINASES INHIBITORS | Chiesi Farmaceutici S.p.A. (IT) | 2018-02-21 | — | — | EP | disclosed |
| WO-2016166239-A1 | CHROMENE DERIVATIVES AS PHOSHOINOSITIDE 3-KINASES INHIBITORS | CHIESI FARMACEUTICI S.P.A. (IT) | 2016-10-20 | — | — | WO | disclosed |