Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 11/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NMT1 | P30419 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8406969 | 0.91 | TP53 (0.38) | TP53SLC6A2SLC6A4SLC6A3NMT1 | |
| SCHEMBL8406794 | 0.85 | SLC6A2 (0.40) | TP53SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL8406730 | 0.84 | DRD2 (0.38) | TP53SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL8408425 | 0.83 | SLC6A2 (0.39) | TP53SLC6A2SLC6A4SLC6A3NMT1 | |
| SCHEMBL8409816 | 0.83 | SLC6A2 (0.39) | TP53SLC6A2SLC6A4SLC6A3NMT1 | |
| SCHEMBL8407524 | 0.81 | KHK (0.36) | TP53SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL8406478 | 0.80 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3NMT1 | |
| SCHEMBL8406925 | 0.79 | DRD2 (0.54) | TP53LMNA | |
| SCHEMBL9093256 | 0.73 | KMT2A (0.39) | — | |
| SCHEMBL8406705 | 0.73 | TP53 (0.37) | TP53SLC6A2SLC6A4SLC6A3IDO1 |
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-5866589-A | Alkyl substituted piperadinyl and piperazinyl anti-AIDS compounds | PHARMACIA & UPJOHN COMPANY (US) | 1999-02-02 | — | — | US | disclosed |
| WO-1996018628-A1 | ALKYL SUBSTITUTED PIPERADINYL AND PIPERAZINYL ANTI-AIDS COMPOUNDS | PHARMACIA & UPJOHN COMPANY (US) | 1996-06-20 | — | — | WO | disclosed |