Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10012128 | 0.78 | MEN1 (0.68) | MEN1KMT2AALDH1A1CYP1A2HPGD | |
| Formic Acid SCHEMBL27906459 | 0.72 | ALDH1A1 (0.52) | MEN1KMT2AALDH1A1MAPK1TDP1 | |
| SCHEMBL12500720 | 0.72 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1MAPK1TDP1 | |
| SCHEMBL22205095 | 0.72 | CYP1A2 (0.46) | MEN1KMT2AALDH1A1MAPK1TDP1 | |
| SCHEMBL28128402 | 0.72 | ALDH1A1 (0.47) | MEN1KMT2AALDH1A1MAPK1TDP1 | |
| SCHEMBL28236960 | 0.71 | CYP1B1 (0.54) | MEN1KMT2AALDH1A1MAPK1TDP1 | |
| SCHEMBL4628576 | 0.71 | CYP1A2 (0.50) | MEN1KMT2AALDH1A1TDP1CYP1A2 | |
| SCHEMBL636521 | 0.71 | CYP1A2 (0.50) | MEN1KMT2AALDH1A1TDP1CYP1A2 | |
| SCHEMBL28171177 | 0.71 | CYP1A2 (0.42) | MEN1KMT2AALDH1A1MAPK1CYP1A2 | |
| Bicarbonate SCHEMBL3836308 | 0.70 | CYP1A2 (0.55) | MEN1KMT2AALDH1A1TDP1CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101180067-A | Combination consisting of a histological or cytological fixing solution and of one or more photoactivatable compounds of the family of quinones, in particular, hypericin, hypocrellin a and hyprcrellin | ERIC PELTIER (FR) | 2008-05-14 | — | — | CN | disclosed |