Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 5/20 | 0.69 |
| ▸ | MERTK | Q12866 | 2/20 | 0.40 |
| ▸ | FBP1 | P09467 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6463 | 0.81 | VCAM1 (1.00) | VCAM1MERTKKAT2BMAPT | |
| SCHEMBL12253372 | 0.81 | VCAM1 (1.00) | VCAM1MERTKKAT2BMAPT | |
| SCHEMBL825866 | 0.71 | VCAM1 (0.53) | VCAM1CA1CA2FLT1FLT4 | |
| SCHEMBL6387 | 0.70 | VCAM1 (0.74) | VCAM1MERTKCA1CA2KAT2B | |
| SCHEMBL3759580 | 0.70 | TSHR (0.50) | VCAM1CA2KDRTSHR | |
| SCHEMBL31053017 | 0.70 | TSHR (0.50) | VCAM1CA2KDRTSHR | |
| SCHEMBL19334475 | 0.68 | TSHR (0.59) | VCAM1MAPTLMNATSHRKMT2A | |
| SCHEMBL21056017 | 0.68 | VCAM1 (0.47) | VCAM1FBP1CA1CA2FLT1 | |
| SCHEMBL2225438 | 0.68 | ALDH1A1 (0.57) | VCAM1FLT1FLT4KDRMAPT | |
| SCHEMBL10931372 | 0.67 | VCAM1 (0.50) | VCAM1CA1CA2FLT1FLT4 |
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-20150364311-A1 | COMPOSITIONS AND METHODS FOR MASS SPECTOMETRY | MSTM, LLC | 2015-12-17 | — | — | US | disclosed |