Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.31 |
| ▸ | CES1 | P23141 | 2/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11580681 | 1.00 | TSHR (0.33) | TSHRTP53CES2CES1DAO | |
| SCHEMBL3412825 | 0.88 | TP53 (0.30) | TSHRTP53 | |
| SCHEMBL15330778 | 0.88 | TP53 (0.30) | TSHRTP53 | |
| SCHEMBL27209675 | 0.88 | TSHR (0.33) | TSHRTP53CES2CES1DAO | |
| SCHEMBL23585193 | 0.85 | — | — | |
| SCHEMBL23073731 | 0.85 | — | — | |
| SCHEMBL28298534 | 0.77 | — | — | |
| SCHEMBL19745504 | 0.77 | — | — | |
| SCHEMBL19745502 | 0.77 | — | — | |
| SCHEMBL19347396 | 0.75 | — | — |
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-4079039-A | POLYBENZIMIDAZOLES, N-HETEROCYCLIC | HORIZONS RESEARCH INCORPORATED (US) | 1978-03-14 | — | — | US | disclosed |