Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 12/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14303441 | 0.91 | HIF1A (0.68) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL4465299 | 0.88 | L3MBTL1 (0.79) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL14767392 | 0.86 | HIF1A (0.68) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL4400208 | 0.86 | HIF1A (0.71) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL14303440 | 0.82 | L3MBTL1 (0.64) | HIF1AL3MBTL1ALDH1A1LMNATSHR | |
| SCHEMBL14304602 | 0.81 | HIF1A (0.60) | HIF1AL3MBTL1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL4778141 | 0.81 | HIF1A (0.82) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL12610042 | 0.80 | HIF1A (0.86) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL12610265 | 0.79 | HIF1A (1.00) | HIF1AL3MBTL1ALDH1A1LMNAPKM | |
| SCHEMBL4458674 | 0.79 | HIF1A (0.60) | HIF1AL3MBTL1ALDH1A1LMNAPKM |
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-2008013840-A2 | ERASTIN ANALOGS AND USES THEREOF | TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2008-01-31 | — | — | WO | disclosed |