Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9700748 | 0.89 | CYP1A2 (0.46) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL9742587 | 0.86 | CYP2C9 (0.33) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL9701948 | 0.80 | MEN1 (0.38) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL9700628 | 0.78 | LAP3 (0.36) | CYP1A2CYP2C9SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL9742726 | 0.76 | CYP1A2 (0.32) | CYP1A2CYP2C9HIF1AALDH1A1NPC1 | |
| SCHEMBL20141004 | 0.73 | ALDH1A1 (0.56) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL29903077 | 0.73 | ALDH1A1 (0.56) | CYP1A2CYP2C9HIF1AALDH1A1SMN1; SMN2 | |
| SCHEMBL9701735 | 0.69 | LTA4H (0.35) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL9700725 | 0.67 | CYP1A2 (0.43) | CYP1A2CYP2C9HIF1A | |
| SCHEMBL7716658 | 0.66 | MMP8 (0.44) | ALDH1A1SMN1; SMN2KMT2ANPC1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992014740-A1 | QUINOXALINE PHOSPHONO-AMINO ACIDS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-09-03 | — | — | WO | disclosed |
| US-5118675-A | Therapy for central nervous system disorders | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-06-02 | — | — | US | disclosed |