Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.46 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TNF | P01375 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8609389 | 0.85 | ALDH1A1 (0.41) | ALDH1A1KDM4ECYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8610724 | 0.83 | FDPS (0.48) | ALDH1A1KDM4EHSD17B10HPGDMEN1 | |
| SCHEMBL7486654 | 0.81 | CYP1A2 (0.49) | ALDH1A1KDM4ECYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8613667 | 0.80 | GRIA1 (0.39) | ALDH1A1KDM4ECYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8622802 | 0.77 | KDM4E (0.38) | ALDH1A1KDM4ECYP1A2HSD17B10HPGD | |
| SCHEMBL9395672 | 0.77 | RORA (0.52) | ALDH1A1KDM4EHSD17B10HPGDTDP1 | |
| SCHEMBL9396447 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1KDM4EHSD17B10HPGDTDP1 | |
| SCHEMBL9395611 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1KDM4EHSD17B10HPGDTDP1 | |
| SCHEMBL7352636 | 0.74 | GRIN2D (0.47) | ALDH1A1KDM4EHSD17B10HPGDMEN1 | |
| SCHEMBL9395727 | 0.74 | KDM4E (0.48) | ALDH1A1KDM4ECYP1A2CYP2C9CYP2C19 |
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-5852017-A | 2,3(1H,4H)-quinoxalinediones | BASF AKTIENGESELLSCHAFT (DE) | 1998-12-22 | — | — | US | disclosed |
| US-5714489-A | 2,3(1H,4H)quinoxalinedione | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-03 | — | — | US | disclosed |