Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30276914 | 1.00 | ALDH1A1 (0.37) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL8002954 | 0.88 | P2RX7 (0.36) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL28542155 | 0.83 | ALDH1A1 (0.33) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL2361070 | 0.83 | TSHR (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL28532178 | 0.83 | ESR1 (0.46) | ALDH1A1CYP2C9CYP2C19TSHR | |
| SCHEMBL10619669 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHR | |
| SCHEMBL28910656 | 0.78 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL700063 | 0.78 | P2RX7 (0.44) | ALDH1A1TDP1 | |
| SCHEMBL7860836 | 0.76 | — | — | |
| SCHEMBL28551168 | 0.75 | CYP1A2 (0.56) | ALDH1A1CYP1A2TSHRTDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5792813-A | Fluorescent organosilicon polymers | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1998-08-11 | — | — | US | disclosed |
| US-5644013-A | POLYMERS WITH ACETYLENE GROUPS FOR DISPLAY SYSTEMS, RADIATION DETECTION SYSTEMS, SEMICONDUCTORS OR LASERS | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 1997-07-01 | — | — | US | disclosed |