Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CTBP2 | P56545 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1515936 | 0.84 | AKR1B1 (0.52) | FAAHPTGS2TP53TDP1ALDH1A1 | |
| SCHEMBL3371585 | 0.84 | FAAH (0.41) | FAAHPTGS2CYP3A4CYP2C9TP53 | |
| SCHEMBL3423556 | 0.84 | CTBP2 (0.44) | CTBP2CES2CES1 | |
| SCHEMBL3624135 | 0.83 | FAAH (0.42) | FAAHPTGS2CYP3A4CYP2C9TP53 | |
| Hydrochloric Acid SCHEMBL3624137 | 0.83 | AKR1B1 (0.50) | FAAHPTGS2TP53TDP1LTB4R | |
| SCHEMBL23365340 | 0.79 | TP53 (0.46) | FAAHPTGS2CYP3A4CYP2C9TP53 | |
| SCHEMBL3816810 | 0.79 | ALDH1A1 (0.42) | CYP3A4CYP2C9TDP1ALDH1A1TSHR | |
| SCHEMBL1137221 | 0.77 | CTBP2 (0.60) | CYP3A4CTBP2KMT2AKDM4EPKM | |
| SCHEMBL11252367 | 0.76 | CTBP2 (0.63) | ALDH1A1CTBP2MEN1KMT2A | |
| SCHEMBL8692259 | 0.76 | SLC1A1 (0.46) | — |
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-0944656-B1 | PROCESS FOR PREPARING RUBBER-MODIFIED MOULDING COMPOUNDS | BASF AG (DE) | 2001-07-11 | — | — | EP | claimed |
| EP-0944656-B1 | PROCESS FOR PREPARING RUBBER-MODIFIED MOULDING COMPOUNDS | BASF AG (DE) | 2001-07-11 | — | — | EP | disclosed |