Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.39 |
| ▸ | MEN1 | O00255 | 7/20 | 0.39 |
| ▸ | HTT | P42858 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL11695585 | 0.90 | TP53 (0.40) | DHFRSLC2A1TP53TSHRSLC6A2 | |
| SCHEMBL11156918 | 0.84 | KDM4E (0.42) | TP53TSHRSLC6A2KMT2AMEN1 | |
| SCHEMBL11497264 | 0.81 | KDM4E (0.41) | TP53TSHRKMT2AMEN1HTT | |
| SCHEMBL11763804 | 0.80 | TP53 (0.38) | TP53TSHRSLC6A2KMT2AMEN1 | |
| SCHEMBL11156736 | 0.80 | TP53 (0.37) | TP53TSHRSLC6A2KMT2AMEN1 | |
| SCHEMBL27687224 | 0.80 | BRD4 (0.41) | TP53TSHRSLC6A2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL9038318 | 0.79 | ALDH1A1 (0.42) | TSHRKMT2AMEN1HTTKDM4E | |
| SCHEMBL1885008 | 0.79 | KMT2A (0.42) | DHFRSLC2A1TP53TSHRSLC6A2 | |
| SCHEMBL11152691 | 0.78 | TP53 (0.36) | TP53TSHRSLC6A2KMT2AMEN1 | |
| SCHEMBL8877184 | 0.77 | TP53 (0.38) | TP53TSHRSLC6A2KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0542497-A1 | Heterocyclic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1993-05-19 | — | — | EP | disclosed |