Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA7 | P43166 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | CDC25A | P30304 | 2/20 | 0.32 |
| ▸ | CDC25B | P30305 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL29771461 | 0.80 | TSHR (0.43) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL4451856 | 0.80 | TSHR (0.43) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL18962306 | 0.78 | TSHR (0.41) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL11414727 | 0.76 | ACHE (0.39) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL21111845 | 0.76 | TSHR (0.35) | TSHRACHECYP3A4TDP1 | |
| SCHEMBL2527886 | 0.75 | CA1 (0.57) | TSHRALDH1A1CA1CA2CA7 | |
| SCHEMBL6230888 | 0.75 | ACHE (0.38) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL29193999 | 0.75 | ACHE (0.38) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL7775590 | 0.75 | TSHR (0.38) | TSHRACHEALDH1A1CA1CA2 | |
| SCHEMBL31413770 | 0.75 | TSHR (0.38) | TSHRACHEALDH1A1CA1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0073413-B1 | ACYLPHOSPHINE OXIDE COMPOUNDS AND THEIR USE | BASF Aktiengesellschaft (DE) | 1984-12-05 | — | — | EP | disclosed |
| US-4447520-A | PHOTOINITIATOR FOR PHOTOPOLYMERIZATION | BASF AKTIENGESELLSCHAFT (DE) | 1984-05-08 | — | — | US | disclosed |
| US-4330461-A | FIREPROOFING POLYESTERS AND POLYAMIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-05-18 | — | — | US | disclosed |
| US-4234729-A | FIREPROOFING POLYMERS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-11-18 | — | — | US | disclosed |