Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MYB | P10242 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 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 | |
|---|---|---|---|---|
| SCHEMBL13639868 | 0.84 | TSHR (0.46) | LMNATSHRALDH1A1MEN1KMT2A | |
| SCHEMBL7571256 | 0.78 | VCAM1 (0.47) | VCAM1LMNATSHRALDH1A1CA1 | |
| SCHEMBL7162214 | 0.78 | ALDH1A1 (0.51) | VCAM1LMNATSHRALDH1A1CA1 | |
| SCHEMBL8535897 | 0.77 | ALDH1A1 (0.51) | VCAM1TSHRALDH1A1CA1CA2 | |
| SCHEMBL8623371 | 0.77 | MEN1 (0.65) | LMNATSHRALDH1A1MEN1KMT2A | |
| SCHEMBL29903883 | 0.77 | MEN1 (0.65) | LMNATSHRALDH1A1MEN1KMT2A | |
| SCHEMBL29450699 | 0.77 | MEN1 (0.65) | LMNATSHRALDH1A1MEN1KMT2A | |
| SCHEMBL187061 | 0.76 | ALDH1A1 (0.63) | LMNATSHRALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL13144060 | 0.76 | VCAM1 (0.59) | VCAM1LMNATSHRALDH1A1CA1 | |
| SCHEMBL17553047 | 0.75 | ERN1 (0.51) | LMNATSHRALDH1A1SMN1; SMN2MEN1 |
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-1999029670-A2 | AMINOCARBONYLTETRALIN AND DIHYDRONAPHTALENE DERIVATES AS THROMBIN INHIBITORS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-06-17 | — | — | WO | disclosed |