Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11391772 | 0.84 | CHRNA7 (0.54) | CHRNA7SLC6A4TAAR1MAOAMAOB | |
| SCHEMBL11385815 | 0.83 | CHRNA7 (0.53) | CHRNA7SLC6A4TAAR1MAOAMAOB | |
| SCHEMBL11413321 | 0.83 | CHRNA7 (0.53) | CHRNA7SLC6A4TAAR1ALDH1A1HPGD | |
| SCHEMBL5690126 | 0.82 | TAAR1 (0.60) | SLC6A4TAAR1HTR2ACHRNB2CHRNA4 | |
| SCHEMBL14258186 | 0.82 | TAAR1 (0.60) | SLC6A4TAAR1HTR2ACHRNB2CHRNA4 | |
| SCHEMBL11397484 | 0.79 | HTR2A (0.44) | CHRNA7SLC6A4MAOAMAOBALDH1A1 | |
| SCHEMBL11382783 | 0.79 | TAAR1 (0.44) | CHRNA7SLC6A4TAAR1MAOAMAOB | |
| SCHEMBL11380548 | 0.77 | SLC6A4 (0.41) | CHRNA7SLC6A4TAAR1MAOAMAOB | |
| SCHEMBL11376821 | 0.77 | SLC6A4 (0.41) | CHRNA7SLC6A4MAOAMAOBALDH1A1 | |
| SCHEMBL11394335 | 0.75 | CHRNA7 (0.51) | CHRNA7SLC6A4TAAR1MAOAMAOB |
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-4285961-A | MICROBIOCIDES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-08-25 | — | — | US | disclosed |