Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.48 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL22425273 | 0.87 | TDP1 (0.46) | LMNAKMT2AMEN1SMN1; SMN2NPC1 | |
| SCHEMBL22425270 | 0.87 | POLB (0.53) | HSD17B10ALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL9969945 | 0.74 | TAAR1 (0.48) | KMT2AMEN1KDM4ECYP3A4NPC1 | |
| SCHEMBL13618285 | 0.74 | ICMT (0.46) | ALDH1A1LMNAHDAC2 | |
| SCHEMBL4858118 | 0.71 | HSD17B10 (0.68) | HSD17B10ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL8477048 | 0.71 | TDP1 (0.70) | HSD17B10SAE1UBA2ALDH1A1LMNA | |
| SCHEMBL22425015 | 0.71 | CYP1A2 (0.51) | HSD17B10SAE1UBA2ALDH1A1KMT2A | |
| SCHEMBL12133 | 0.70 | HSD17B10 (1.00) | HSD17B10ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL30703669 | 0.70 | HSD17B10 (1.00) | HSD17B10ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL18499179 | 0.70 | HSD17B10 (0.66) | HSD17B10SAE1UBA2ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020186202-A1 | SMALL MOLECULE GRB2 STABILIZERS FOR RAS MAP KINASE INHIBITION | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2020-09-17 | — | — | WO | disclosed |