Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.52 |
| ▸ | WNT3A | P56704 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | P4HTM | Q9NXG6 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | METAP1 | P53582 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28561412 | 0.77 | CTNNB1 (0.55) | CTNNB1WNT3AKMT2AKDM4ELMNA | |
| SCHEMBL2890937 | 0.75 | KMT2A (0.63) | CTNNB1WNT3AKMT2AKDM4ELMNA | |
| SCHEMBL9901809 | 0.75 | CTNNB1 (0.48) | CTNNB1WNT3AKMT2AKDM4ELMNA | |
| SCHEMBL1260719 | 0.75 | KMT2A (0.63) | KMT2AKDM4ELMNAP4HTMCYP1A2 | |
| SCHEMBL28961178 | 0.73 | CYP19A1 (0.66) | CTNNB1WNT3AKDM4ELMNAPOLB | |
| SCHEMBL143 | 0.73 | CES1 (0.53) | KMT2AKDM4ELMNAPOLBBLM | |
| SCHEMBL733007 | 0.70 | KMT2A (0.65) | KMT2AKDM4ECYP1A2HIF1ARAB9A | |
| Bromide SCHEMBL28972076 | 0.70 | CES1 (0.50) | KMT2AKDM4ELMNAPOLBBLM | |
| Methane SCHEMBL29155195 | 0.70 | CES1 (0.50) | KMT2AKDM4ELMNAPOLBBLM | |
| SCHEMBL28911317 | 0.70 | CES1 (0.50) | KMT2AKDM4ELMNAPOLBBLM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0922042-A1 | NOVEL PIPERAZINE CONTAINING COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-06-16 | — | — | EP | claimed |
| WO-1998006715-A1 | NOVEL PIPERAZINE CONTAINING COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-02-19 | — | — | WO | claimed |