Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 2/20 | 0.37 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.35 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28852475 | 0.87 | CES2 (0.41) | TSHRAKR1B1ALDH1A1CES2CES1 | |
| SCHEMBL11241971 | 0.83 | ALDH1A1 (0.41) | TSHRAKR1B1ALDH1A1KMT2ACES2 | |
| SCHEMBL5179498 | 0.81 | ALDH1A1 (0.40) | TSHRAKR1B1ALDH1A1KMT2ACES2 | |
| SCHEMBL11271848 | 0.80 | ALDH1A1 (0.45) | TSHRAKR1B1ALDH1A1KMT2ACES2 | |
| SCHEMBL365284 | 0.77 | MEN1 (0.46) | ALDH1A1KMT2ACES2CES1MEN1 | |
| SCHEMBL5112227 | 0.77 | MEN1 (0.46) | ALDH1A1KMT2ACES2CES1MEN1 | |
| SCHEMBL8128086 | 0.77 | MEN1 (0.46) | ALDH1A1KMT2ACES2CES1MEN1 | |
| SCHEMBL9274763 | 0.76 | PDK1 (0.39) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL9125705 | 0.76 | KMT2A (0.40) | TSHRALDH1A1KMT2AMEN1 | |
| SCHEMBL11686588 | 0.74 | KMT2A (0.47) | TSHRAKR1B1ALDH1A1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4318915-A | Substituted guandines and methods of preparation thereof | BEIERSDORF AKTIENGESELLSCHAFT (DE) | 1982-03-09 | — | — | US | disclosed |