Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | BTK | Q06187 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | ACR | P10323 | 1/20 | 0.33 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17354265 | 0.96 | ABL1 (0.34) | ABL1TAAR1BTKPDCD1CD274 | |
| SCHEMBL17354301 | 0.92 | ABL1 (0.33) | MAPTABL1ALDH1A1TAAR1SMN1; SMN2 | |
| SCHEMBL17354263 | 0.89 | ABL1 (0.33) | ABL1TAAR1BTKPDCD1CD274 | |
| SCHEMBL17354225 | 0.88 | CNR1 (0.36) | MAPTSMN1; SMN2POLBBTKCNR1 | |
| SCHEMBL17354218 | 0.88 | CA2 (0.38) | MAPTALDH1A1SMN1; SMN2POLBBTK | |
| SCHEMBL17354162 | 0.88 | KDR (0.36) | MAPTALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL17354196 | 0.88 | CNR1 (0.41) | MAPTALDH1A1TAAR1SMN1; SMN2POLB | |
| SCHEMBL14134 | 0.87 | ABL1 (0.39) | ABL1 | |
| SCHEMBL13669 | 0.87 | CNR1 (0.45) | TAAR1CNR1MEN1KMT2A | |
| SCHEMBL14203 | 0.87 | CNR1 (0.40) | ABL1BTKCNR1CD274BDKRB1 |
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-9216979-B2 | Antimicrobial compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2015-12-22 | — | — | US | disclosed |