Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13374205 | 0.81 | KMT2A (0.50) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL18211553 | 0.81 | KMT2A (0.50) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL2454068 | 0.79 | KMT2A (0.60) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL1085009 | 0.79 | KMT2A (0.50) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL2454069 | 0.79 | KMT2A (0.60) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL29664634 | 0.75 | ALOX5 (0.46) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL15272327 | 0.73 | KMT2A (0.58) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL15272598 | 0.73 | KMT2A (0.58) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL11151822 | 0.73 | KMT2A (0.58) | KMT2APOLBPTPN1PKMPTPN7 | |
| SCHEMBL14944873 | 0.72 | KDM4E (0.48) | KMT2APOLBPTPN1PKMPTPN7 |
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 |
|---|---|---|---|---|---|---|---|
| US-8431599-B2 | 3-aryl-3-hydroxy-2-amino-propionic acid amides, 3-heteroaryl-3-hydroxy-2-amino-propionic acid amides and related compounds having analgesic and/or immuno stimulant activity | ALLERGAN, INC. (US) | 2013-04-30 | — | — | US | disclosed |