Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2713018 | 0.84 | — | — | |
| SCHEMBL23992 | 0.84 | — | — | |
| SCHEMBL30487170 | 0.84 | — | — | |
| SCHEMBL11485188 | 0.84 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL2686745 | 0.84 | — | — | |
| Ammonia Solution, Strong SCHEMBL2909006 | 0.81 | — | — | |
| Isobutane SCHEMBL3410753 | 0.81 | TSHR (0.31) | TSHRTDP1 | |
| Methane SCHEMBL11669299 | 0.81 | — | — | |
| Iodide SCHEMBL31325854 | 0.81 | — | — | |
| Water SCHEMBL29494590 | 0.81 | — | — |
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-5043471-A | Process for the preparation of polyisocyanates | BAYER AKTIENGESELLSCHAFT (DE) | 1991-08-27 | — | — | US | disclosed |