Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | TACR1 | P25103 | 4/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5138333 | 0.87 | HTR6 (0.45) | KDM4ESMN1; SMN2IDO1MAPTLMNA | |
| SCHEMBL4600343 | 0.80 | DBH (0.37) | HTTSMN1; SMN2IDO1LMNAALDH1A1 | |
| SCHEMBL27731268 | 0.79 | ICMT (0.52) | MAPTLMNATP53RXFP1ICMT | |
| SCHEMBL694560 | 0.77 | TNF (0.44) | KDM4ESMN1; SMN2LMNAALDH1A1TSHR | |
| SCHEMBL3849945 | 0.75 | ALDH1A1 (0.46) | KDM4EHTTSMN1; SMN2MAPTLMNA | |
| SCHEMBL27751731 | 0.74 | KIF11 (0.42) | MAPTLMNAICMTHTR6PTGS2 | |
| SCHEMBL3856954 | 0.74 | AGXT (0.43) | MAPTLMNAICMTHTR6PTGS2 | |
| SCHEMBL17956236 | 0.73 | CNR1 (0.40) | KDM4EMAPTALDH1A1HTR6 | |
| SCHEMBL27905750 | 0.73 | HTT (0.49) | HTTSMN1; SMN2IDO1MAPTLMNA | |
| SCHEMBL6087143 | 0.73 | HTR6 (0.54) | KDM4EHTTSMN1; SMN2HTR6 |
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-1956910-A2 | ONCOGENIC RAS-SPECIFIC CYTOTOXIC COMPOUND AND METHODS OF USE THEREOF | The Board of Regents of The University of Texas System (US) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007062399-A2 | ONCOGENIC RAS-SPECIFIC CYTOTOXIC COMPOUND AND METHODS OF USE THEREOF | THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2007-05-31 | — | — | WO | disclosed |