Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12455605 | 1.00 | TSHR (0.58) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL9949471 | 0.86 | TSHR (0.55) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL9949467 | 0.86 | TSHR (0.55) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL26724832 | 0.84 | CYP1A2 (0.49) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL21670255 | 0.84 | TSHR (0.53) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL14009862 | 0.84 | TSHR (0.64) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL21670252 | 0.84 | TSHR (0.64) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL26724618 | 0.81 | MAPK1 (0.51) | TSHRCYP1A2KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL7820601 | 0.80 | ALDH1A1 (0.70) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL12305027 | 0.80 | BCHE (0.55) | TSHRCYP1A2KMT2AALDH1A1SMN1; SMN2 |
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-2020028482-A1 | SMALL MOLECULES THAT SENSITIZE HIV-1 INFECTED CELLS TO ANTIBODY DEPENDENT CELLULAR CYTOTOXICITY | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2020-02-06 | — | — | WO | disclosed |