Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | AHR | P35869 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | CHAT | P28329 | 4/20 | 0.49 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | GUSB | P08236 | 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 | |
|---|---|---|---|---|
| SCHEMBL16593373 | 1.00 | CYP1A2 (0.50) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 | |
| SCHEMBL10706687 | 0.83 | CHAT (0.62) | ALDH1A1HSD17B10CHATRXRAKDM4E | |
| SCHEMBL10706694 | 0.83 | CHAT (0.62) | ALDH1A1HSD17B10CHATRXRAKDM4E | |
| SCHEMBL10706700 | 0.83 | CHAT (0.62) | ALDH1A1HSD17B10CHATRXRAKDM4E | |
| SCHEMBL31550572 | 0.83 | RELA (0.46) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 | |
| SCHEMBL131581 | 0.83 | RELA (0.46) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 | |
| SCHEMBL131580 | 0.83 | RELA (0.46) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 | |
| SCHEMBL9407210 | 0.82 | ALDH1A1 (0.45) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 | |
| SCHEMBL9099842 | 0.82 | ALDH1A1 (0.45) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 | |
| SCHEMBL3717833 | 0.81 | CYP1A2 (0.40) | CYP1A2ALDH1A1HPGDHSD17B10ERBB2 |
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-9766213-B2 | Innovation to assay mixing | BIO-RAD LABORATORIES, INC. (US) | 2017-09-19 | — | — | US | disclosed |
| US-20150090343-A1 | INNOVATION TO ASSAY MIXING | BIO-RAD LABORATORIES, INC. | 2015-04-02 | — | — | US | disclosed |