Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | CXCR5 | P32302 | 2/20 | 0.50 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.41 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.41 |
| ▸ | CD38 | P28907 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6013405 | 0.98 | CXCR5 (0.51) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL27556126 | 0.93 | CYP3A4 (0.46) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL28371050 | 0.92 | LMNA (0.55) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL6535320 | 0.92 | LMNA (0.55) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL27405674 | 0.92 | LMNA (0.55) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL5370893 | 0.90 | CYP3A4 (0.53) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL4235369 | 0.88 | CXCR5 (0.49) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL28850518 | 0.86 | BID (0.50) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL29652142 | 0.86 | PLK1 (0.50) | LMNACYP3A4MEN1KMT2ANR1I2 | |
| SCHEMBL6720660 | 0.86 | PLK1 (0.50) | LMNACYP3A4MEN1KMT2ANR1I2 |
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-7126027-B2 | N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives | AKZO NOBEL N.V. (NL) | 2006-10-24 | — | — | US | disclosed |
| US-6743794-B2 | MULTIDRUG RESISTANCE PROTEIN; CANCER; 3-(9-CHLORO-3-METHYL-4-OXO-5H-ISOXAZOLO(4,3-C)QUINOLIN-5-YL)) CYCLOHEXYL)-2-PIPERIDYLACETAMIDE | ELI LILLY AND COMPANY | 2004-06-01 | — | — | US | disclosed |