Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10785400 | 0.80 | MAOA (0.40) | MAOAMAOBALDH1A1ADRB2HTT | |
| SCHEMBL4327271 | 0.72 | MAOA (0.33) | MAOAMAOB | |
| SCHEMBL10619983 | 0.67 | MAOA (0.36) | MAOAMAOBALDH1A1KMT2AMEN1 | |
| SCHEMBL3335699 | 0.67 | TSHR (0.35) | MAOAMAOBKMT2AMEN1TSHR | |
| SCHEMBL8283763 | 0.67 | MAOA (0.42) | MAOAMAOBHTTLMNANPSR1 | |
| SCHEMBL18543270 | 0.66 | CTSL (0.36) | MAOAMAOBKMT2AMEN1TSHR | |
| SCHEMBL10785405 | 0.66 | MAOA (0.37) | MAOAMAOBALDH1A1ADRB2HTT | |
| SCHEMBL433971 | 0.64 | MAOA (0.83) | MAOAMAOB | |
| SCHEMBL22798189 | 0.64 | MAOA (0.50) | MAOAMAOBALDH1A1ADRB2HTT | |
| SCHEMBL10619976 | 0.64 | POLB (0.36) | ALDH1A1 |
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-4603189-A | Triisocyanates and a process for their preparation | BAYER AKTIENGESELLSCHAFT (DE) | 1986-07-29 | — | — | US | disclosed |
| EP-0162346-A1 | Triisocyanates, process for their production, and their use in the manufacture of polyurethanes | BAYER AG (DE) | 1985-11-27 | — | — | EP | disclosed |