Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.71 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| M-Xylene SCHEMBL11786968 | 0.84 | ACHE (0.86) | ACHETP53TDP1ALDH1A1MAPK1 | |
| M-Xylene SCHEMBL10427453 | 0.84 | ACHE (0.86) | ACHETP53TDP1ALDH1A1MAPK1 | |
| M-Xylene SCHEMBL27372743 | 0.84 | ACHE (0.86) | ACHETP53TDP1ALDH1A1MAPK1 | |
| M-Xylene SCHEMBL891494 | 0.84 | ACHE (1.00) | ACHETP53TDP1ALDH1A1MAPK1 | |
| M-Xylene SCHEMBL28189 | 0.84 | — | — | |
| M-Xylene SCHEMBL6397624 | 0.84 | — | — | |
| M-Xylene SCHEMBL18496754 | 0.83 | ACHE (0.55) | ACHEALDH1A1LMNAHSD17B10PARP1 | |
| M-Xylene SCHEMBL509876 | 0.82 | ACHE (0.71) | ACHETDP1ALDH1A1MAPK1LMNA | |
| M-Xylene SCHEMBL19743267 | 0.81 | ACHE (0.80) | ACHETP53TDP1ALDH1A1MAPK1 | |
| M-Xylene SCHEMBL28938295 | 0.81 | ACHE (0.80) | ACHETP53TDP1ALDH1A1MAPK1 |
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-2023081930-A1 | CHROMIUM PHOSPHINYL ISOINDOLE AMIDINE COMPLEXES FOR TETRAMERIZATION OF ETHYLENE | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2023-05-11 | — | — | WO | disclosed |