Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | RGS12 | O14924 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6256616 | 0.86 | MMP13 (0.59) | ALDH1A1MAPTLMNAMMP13SLC22A8 | |
| SCHEMBL6724632 | 0.85 | MMP13 (0.53) | ALDH1A1KDM4EMAPTLMNAMMP13 | |
| SCHEMBL10085642 | 0.83 | TP53 (0.51) | ALDH1A1KDM4ELMNAPARGTP53 | |
| SCHEMBL7634243 | 0.83 | TP53 (0.57) | MAPTMMP13SLC22A8PARGTP53 | |
| SCHEMBL5696996 | 0.81 | MMP13 (0.55) | LMNAMMP13SLC22A8KMT2APARG | |
| SCHEMBL6234634 | 0.80 | MMP13 (0.58) | ALDH1A1KDM4EMAPTLMNAMMP13 | |
| SCHEMBL7018313 | 0.79 | MMP13 (0.59) | ALDH1A1MAPTLMNAMMP13SLC22A8 | |
| SCHEMBL6466889 | 0.79 | P2RX4 (0.64) | ALDH1A1KDM4EMAPTLMNAMEN1 | |
| SCHEMBL5922715 | 0.79 | MMP13 (0.52) | ALDH1A1KDM4EMAPTHSD17B10TSHR | |
| SCHEMBL7100732 | 0.79 | PIK3CD (0.51) | ALDH1A1KDM4EMAPTLMNAMMP13 |
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-6407116-B1 | 2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLINE DERIVATIVES; ANTIALLERGENS, ANTIASTHMATICS, ANTIHISTAMINES, AND ANTIINFLAMMATORY AGENTS | TAKEDA CHEMICAL INDUSTRIES, INC. (JP) | 2002-06-18 | — | — | US | disclosed |
| EP-1026160-A1 | NITROGENOUS FUSED-RING COMPOUNDS, PROCESS FOR THE PREPARATION OF THE SAME, AND DRUGS | Takeda Chemical Industries, Ltd. (JP) | 2000-08-09 | — | — | EP | disclosed |