Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.48 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RGS12 | O14924 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | APAF1 | O14727 | 4/20 | 0.43 |
| ▸ | USP2 | O75604 | 4/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.43 |
| ▸ | UBE2N | P61088 | 2/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | IDE | P14735 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18970013 | 0.84 | KDM4E (0.54) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL18968643 | 0.83 | KMT2A (0.57) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL18968635 | 0.83 | MAPK1 (0.50) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL18968672 | 0.79 | KMT2A (0.50) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL18968671 | 0.78 | SMN1; SMN2 (0.47) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL18968668 | 0.78 | HTT (0.48) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL18968636 | 0.77 | HTT (0.55) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL18968673 | 0.77 | MAPK1 (0.48) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL18968669 | 0.76 | KMT2A (0.48) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 | |
| SCHEMBL3834029 | 0.75 | ATM (0.51) | KDM4ESMN1; SMN2ATMALDH1A1HSD17B10 |
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-2017100525-A1 | SUBSTITUTED BENZIMIDAZOLIUM, PYRIDO-IMIDAZOLIUM, OR PYRAZINO-IMIDAZOLIUM COMPOUNDS AS CHEMOTHERAPEUTICS | THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2017-06-15 | — | — | WO | disclosed |