Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | F3 | P13726 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31538759 | 1.00 | TSHR (0.54) | TSHRCA1CA2MAPTXDH | |
| SCHEMBL6372930 | 0.82 | TSHR (0.54) | TSHRMAPTMEN1KMT2AHPGD | |
| SCHEMBL9316413 | 0.80 | CA1 (0.59) | CA1CA2MAPTXDHKDM4E | |
| SCHEMBL6374669 | 0.79 | TSHR (0.50) | TSHRMAPTKDM4EMEN1KMT2A | |
| SCHEMBL11414046 | 0.78 | ALDH1A1 (0.48) | MAPTAKR1C3AKR1C2GAA | |
| SCHEMBL9316470 | 0.78 | TP53 (0.50) | CA1CA2MAPTXDHKDM4E | |
| SCHEMBL31538747 | 0.78 | TP53 (0.50) | CA1CA2MAPTXDHKDM4E | |
| SCHEMBL9315902 | 0.75 | NPC1 (0.49) | TSHRMAPTKDM4EMEN1KMT2A | |
| SCHEMBL31538763 | 0.75 | NPC1 (0.49) | TSHRMAPTKDM4EMEN1KMT2A | |
| SCHEMBL5151922 | 0.71 | MAPT (0.68) | TSHRMAPTGFERMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5310620-A | Alkali-soluble nitrone compounds and contrast enhanced material comprising the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1994-05-10 | — | — | US | disclosed |