Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 11/20 | 0.79 |
| ▸ | MEN1 | O00255 | 7/20 | 0.79 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.79 |
| ▸ | MAPT | P10636 | 7/20 | 0.79 |
| ▸ | LMNA | P02545 | 6/20 | 0.79 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.79 |
| ▸ | HTT | P42858 | 3/20 | 0.79 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.79 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 6/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11845603 | 0.88 | SMN1; SMN2 (1.00) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL4348625 | 0.84 | SMN1; SMN2 (0.71) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL4347357 | 0.83 | SMN1; SMN2 (0.62) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL4359761 | 0.83 | RAB9A (0.73) | SMN1; SMN2MEN1KMT2ALMNAHTT | |
| SCHEMBL6565598 | 0.82 | SMN1; SMN2 (0.68) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL28756963 | 0.81 | SMN1; SMN2 (0.83) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL11697622 | 0.80 | NPSR1 (1.00) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL4348605 | 0.80 | SMN1; SMN2 (0.55) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL12239184 | 0.79 | S1PR1 (0.57) | SMN1; SMN2MEN1KMT2AMAPTLMNA | |
| SCHEMBL26123831 | 0.78 | MEN1 (1.00) | SMN1; SMN2MEN1KMT2AMAPTLMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100546977-C | Suppress the new compound and the application thereof of rotamase | JERINI AG (DE) | 2009-10-07 | — | — | CN | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | claimed |
| CN-1701061-A | Novel compounds for inhibiting rotamase enzymes and uses thereof | JERINI AG (DE) | 2005-11-23 | — | — | CN | claimed |
| WO-2004030664-A2 | NEW COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF | JERINI AG (DE) | 2004-04-15 | — | — | WO | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |