Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8736686 | 0.87 | ALDH1A1 (0.43) | TSHRMAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL8457131 | 0.86 | TSHR (0.49) | TSHRALDH1A1SMN1; SMN2POLBLMNA | |
| SCHEMBL8154438 | 0.83 | TSHR (0.49) | TSHRALDH1A1SMN1; SMN2POLBLMNA | |
| SCHEMBL8159050 | 0.82 | TSHR (0.48) | TSHRALDH1A1SMN1; SMN2POLBLMNA | |
| SCHEMBL8457112 | 0.77 | SMN1; SMN2 (0.51) | TSHRALDH1A1SMN1; SMN2POLBFDPS | |
| SCHEMBL6641533 | 0.76 | TSHR (0.48) | TSHRALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL8734087 | 0.74 | HDAC3 (0.47) | TSHRSMN1; SMN2LMNAMAPTMAPK1 | |
| SCHEMBL6646146 | 0.73 | HPGD (0.49) | TSHRALDH1A1MAPTMAPK1TBXAS1 | |
| SCHEMBL6643753 | 0.73 | HPGD (0.49) | TSHRALDH1A1MAPTMAPK1TBXAS1 | |
| SCHEMBL6643632 | 0.73 | HPGD (0.49) | TSHRALDH1A1MAPTMAPK1TBXAS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5880112-A | PHOSPHINIC ACID DERIVATIVES; PROSTATE CANCER TREATMENT | GUILFORD PHARMACEUTICALS INC. (US) | 1999-03-09 | — | — | US | disclosed |
| US-5804602-A | N-ACETYLATED ALPHA-LINKED ACIDIC DIPEPTIDASE INHIBITORS | GUILFORD PHARMACEUTICALS INC. (US) | 1998-09-08 | — | — | US | disclosed |
| US-5672592-A | HYDROLASE INHIBITORS, ANTITUMOR AND ANTICARCINOGENIC AGENTS, FOR PROSTATE CANCER | GUILFORD PHARMACEUTICALS INC. (US) | 1997-09-30 | — | — | US | disclosed |