Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT6A | Q92794 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4743346 | 0.82 | ESR1 (0.42) | KDM4EALDH1A1HPGDHSD17B10MYC | |
| SCHEMBL4636735 | 0.82 | CES2 (0.57) | KAT6AALDH1A1HPGDCES2BCHE | |
| SCHEMBL4936719 | 0.82 | ERCC5 (0.46) | HPGDMYCERCC5FEN1KMT2A | |
| SCHEMBL10991228 | 0.76 | CES2 (0.44) | CES2CES1KMT2APOLBMEN1 | |
| SCHEMBL10637292 | 0.76 | L3MBTL1 (0.38) | KDM4EALDH1A1HPGDHSD17B10MYC | |
| SCHEMBL10644835 | 0.75 | KAT6A (0.49) | KAT6AKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL3395153 | 0.75 | ALDH1A1 (0.42) | KDM4EALDH1A1HPGDHSD17B10CES2 | |
| SCHEMBL4145212 | 0.74 | CES2 (0.54) | KAT6AALDH1A1HPGDCES2BCHE | |
| SCHEMBL27533336 | 0.74 | TSHR (0.45) | KDM4EALDH1A1HPGDHSD17B10MYC | |
| SCHEMBL34472768 | 0.74 | NR4A1 (0.38) | KDM4EALDH1A1HPGDHSD17B10CES2 |
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-1603888-A1 | 2-(3-PHENYL-2-PIPERAZINYL-3,4-DIHYDROQUINAZOLINE-4-YL) ACETIC ACIDS AS ANTI-VIRAL AGENTS, ESPECIALLY AGAINST CYTOMEGALO VIRUSES | Bayer HealthCare AG (DE) | 2005-12-14 | — | — | EP | disclosed |
| WO-2004072048-A1 | 2-(3-PHENYL-2-PIPERAZINYL-3,4-DIHYDROQUINAZOLINE-4-YL) ACETIC ACIDS AS ANTI-VIRAL AGENTS, ESPECIALLY AGAINST CYTOMEGALO VIRUSES | BAYER HEALTHCARE AG (DE) | 2004-08-26 | — | — | WO | disclosed |