Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.34 |
| ▸ | TXNRD3 | Q86VQ6 | 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 | |
|---|---|---|---|---|
| SCHEMBL158241 | 0.80 | SIRT1 (0.42) | CYP3A4TSHRMAPTRAB9AMEN1 | |
| SCHEMBL4558245 | 0.78 | NPC1 (0.41) | TSHRMAPTRAB9ALMNAKDM4E | |
| SCHEMBL24325340 | 0.76 | ALDH1A1 (0.54) | MAPK1MAPTRAB9AMEN1KMT2A | |
| SCHEMBL6465460 | 0.75 | TSHR (0.52) | TSHRMAPK1MAPTMEN1KMT2A | |
| SCHEMBL14268630 | 0.75 | KMT2A (0.50) | CYP3A4MAPK1MAPTRAB9AMEN1 | |
| SCHEMBL28646192 | 0.75 | NNMT (0.47) | ALDH1A1KDM4ESMN1; SMN2HSD17B10GAA | |
| SCHEMBL6562201 | 0.72 | EPHX1 (0.51) | MAPTRAB9AMEN1KMT2ALMNA | |
| SCHEMBL6034931 | 0.72 | MTNR1A (0.42) | CYP3A4MAPTRAB9ALMNAALDH1A1 | |
| SCHEMBL23181647 | 0.71 | CYP3A4 (0.55) | CYP3A4TSHRMAPK1MAPTRAB9A | |
| SCHEMBL23732780 | 0.69 | HDAC2 (0.51) | MAPTRAB9AMEN1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017156181-A1 | 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF | RAZE THERAPEUTICS, INC. (US) | 2017-09-14 | — | — | WO | disclosed |
| CN-101466692-A | Thiazol-guanidine derivatives useful as a (beta) - related pathologies | ASTRAZENECA AB (SE) | 2009-06-24 | — | — | CN | disclosed |