Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KYNU | Q16719 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17921713 | 0.89 | SYK (0.45) | KYNUALDH1A1ALOX15CYP3A4TSHR | |
| SCHEMBL16156790 | 0.89 | SYK (0.45) | KYNUALDH1A1ALOX15CYP3A4TSHR | |
| SCHEMBL16156798 | 0.86 | CTRB1 (0.40) | KYNUALDH1A1ALOX15CYP3A4TSHR | |
| SCHEMBL14905978 | 0.86 | CTRB1 (0.40) | KYNUALDH1A1ALOX15CYP3A4TSHR | |
| SCHEMBL14905926 | 0.86 | CTRB1 (0.39) | KYNUALDH1A1ALOX15CYP3A4TSHR | |
| SCHEMBL31558997 | 0.76 | ESR1 (0.42) | KYNUALDH1A1ALOX15CYP3A4TSHR | |
| SCHEMBL6359630 | 0.74 | CTSL (0.41) | ALDH1A1ALOX15CYP3A4TSHRMEN1 | |
| SCHEMBL16154113 | 0.73 | ALDH1A1 (0.37) | ALDH1A1TSHRMAPTSMN1; SMN2 | |
| SCHEMBL16156832 | 0.73 | ABCB1 (0.37) | ALDH1A1CTSB | |
| SCHEMBL16156885 | 0.73 | LTA4H (0.35) | KYNUALDH1A1LMNAHSD17B10CTSB |
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-2771343-B1 | METHYLTRANSFERASE INHIBITORS FOR TREATING CANCER | SLOAN KETTERING INST CANCER (US) | 2016-07-13 | — | — | EP | disclosed |
| WO-2013063417-A1 | METHYLTRANSFERASE INHIBITORS FOR TREATING CANCER | MEMORIAL SLOAN-KETTERING CANCER CENTER (US) | 2013-05-02 | — | — | WO | disclosed |