Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 2/20 | 0.58 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | PLA2G10 | O15496 | 2/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.41 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28116797 | 0.89 | CFD (0.44) | HTR7PLA2G10PLA2G2AAOC3MEN1 | |
| SCHEMBL28116861 | 0.85 | BCL2 (0.49) | HTR7PLA2G10PLA2G2AMEN1ALDH1A1 | |
| SCHEMBL9696125 | 0.78 | HSP90AB1 (0.49) | MEN1KMT2APDK2 | |
| SCHEMBL27627678 | 0.78 | LTB4R2 (0.47) | TAAR1MEN1ALDH1A1KMT2APDK2 | |
| SCHEMBL3420505 | 0.77 | BCAT2 (0.57) | MEN1ALDH1A1KMT2APDK2CHRNB2 | |
| SCHEMBL30505632 | 0.77 | BCAT2 (0.57) | MEN1ALDH1A1KMT2APDK2CHRNB2 | |
| SCHEMBL28837363 | 0.77 | ALDH1A1 (0.50) | MEN1ALDH1A1KMT2APDK2 | |
| SCHEMBL27966450 | 0.77 | TUBB4A (0.50) | MEN1KMT2APDK2 | |
| SCHEMBL28024823 | 0.77 | CHRM1 (0.49) | PDK2 | |
| SCHEMBL27539512 | 0.75 | BCAT2 (0.55) | MEN1ALDH1A1KMT2APDK2CHRNB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997046547-A1 | β-SHEET NUCLEATING PEPTIDOMIMETICS | THE TEXAS A & M UNIVERSITY SYSTEM (US) | 1997-12-11 | — | — | WO | disclosed |