Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 5/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.31 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.30 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.30 |
| ▸ | GNAI1 | P63096 | 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 | |
|---|---|---|---|---|
| SCHEMBL19861431 | 0.95 | ALDH1A1 (0.37) | ALDH1A1TSHRTDP1MAOBHRH3 | |
| SCHEMBL15183642 | 0.84 | CHRM4 (0.32) | ALDH1A1TSHRTDP1 | |
| SCHEMBL15187266 | 0.84 | DRD2 (0.38) | ALDH1A1TSHRTDP1GNAI3GNAO1 | |
| SCHEMBL15187179 | 0.84 | DRD2 (0.41) | ALDH1A1TSHRTDP1GNAI3GNAO1 | |
| SCHEMBL15187328 | 0.82 | GNAO1 (0.47) | GNAI3GNAO1GNAI1 | |
| SCHEMBL15183661 | 0.82 | CHRM4 (0.33) | ALDH1A1TSHRTDP1 | |
| SCHEMBL15187160 | 0.80 | DRD2 (0.41) | ALDH1A1TSHRTDP1GNAI3GNAO1 | |
| SCHEMBL15183659 | 0.80 | CHRM4 (0.32) | ALDH1A1TSHRTDP1 | |
| SCHEMBL15187320 | 0.79 | GNAO1 (0.47) | GNAI3GNAO1GNAI1 | |
| SCHEMBL15183778 | 0.79 | GNAI3 (0.32) | HRH3GNAI3GNAO1GNAI1 |
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-9890198-B2 | Cyclosporin derivatives and uses thereof | S&T GLOBAL INC. (US) | 2018-02-13 | — | — | US | disclosed |