Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 6/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.47 |
| ▸ | GNRHR | P30968 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.45 |
| ▸ | CASP7 | P55210 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21684642 | 0.85 | TBXA2R (0.48) | MAP4K1AGTR1AGTR2GNRHRRAB9A | |
| SCHEMBL21703331 | 0.85 | MAP4K1 (0.53) | MAP4K1RAB9AALDH1A1KDM4EMEN1 | |
| SCHEMBL21685620 | 0.81 | ALDH1A1 (0.55) | AGTR1AGTR2GNRHRRAB9AALDH1A1 | |
| SCHEMBL21703186 | 0.80 | TBXA2R (0.50) | MAP4K1AGTR1AGTR2RAB9ATBXA2R | |
| SCHEMBL23452789 | 0.79 | MAP4K1 (0.60) | MAP4K1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL21684766 | 0.78 | MAP4K1 (0.62) | MAP4K1 | |
| SCHEMBL24859765 | 0.77 | MAP4K1 (0.45) | MAP4K1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL21703339 | 0.76 | BRD4 (0.50) | AGTR1AGTR2RAB9AALDH1A1LMNA | |
| SCHEMBL21703260 | 0.76 | MAP4K1 (0.49) | MAP4K1AGTR1AGTR2RAB9AKDM4E | |
| SCHEMBL25944269 | 0.75 | MAP4K1 (0.56) | MAP4K1ALDH1A1SMN1; SMN2TBXA2RL3MBTL1 |
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-2020033784-A1 | TRANSGLUTAMINASE 2 (TG2) INHIBITORS | SITARI PHARMA, INC. (US) | 2020-02-13 | — | — | WO | disclosed |