Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | NPC1 | O15118 | 2/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5567501 | 1.00 | KDM4E (0.64) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL5501485 | 0.94 | KDM4E (0.58) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL361837 | 0.92 | KDM4E (0.58) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL6532154 | 0.91 | KDM4E (0.57) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL5499989 | 0.91 | KDM4E (0.57) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL3284414 | 0.91 | SMN1; SMN2 (0.57) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL28341714 | 0.91 | SMN1; SMN2 (0.57) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL7838137 | 0.90 | KDM4E (0.61) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL2920128 | 0.89 | KDM4E (0.60) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL27958219 | 0.89 | CYP2D6 (0.66) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A |
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-1218355-A1 | THERAPEUTIC QUINAZOLINE DERIVATIVES | AstraZeneca AB (SE) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001021597-A1 | THERAPEUTIC QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2001-03-29 | — | — | WO | disclosed |