Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | FABP4 | P15090 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30411927 | 0.79 | ALDH1A1 (0.44) | PTK2KMT2AALDH1A1SMN1; SMN2HTT | |
| SCHEMBL5661381 | 0.79 | ALDH1A1 (0.44) | PTK2KMT2AALDH1A1SMN1; SMN2HTT | |
| SCHEMBL7513251 | 0.78 | PTK2 (0.44) | PTK2KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL28894224 | 0.77 | MAOB (0.49) | MAOBKMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL17067714 | 0.75 | HSP90AA1 (0.46) | MAOBPTK2KMT2AMEN1MAPT | |
| SCHEMBL5432686 | 0.74 | LMNA (0.44) | MAPTALDH1A1MAPK1ROCK1SMN1; SMN2 | |
| SCHEMBL6298933 | 0.74 | KMT2A (0.51) | PTK2KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL6298250 | 0.72 | MAPK1 (0.46) | PTK2KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL6363237 | 0.71 | CYP19A1 (0.54) | KMT2AMEN1MAPTALDH1A1MAPK1 | |
| SCHEMBL29126953 | 0.71 | ALDH1A1 (0.52) | MAPTALDH1A1MAPK1SMN1; SMN2RAB9A |
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-2004099139-A1 | INDOLE-CONTAINING COMPOUNDS WITH ANTI-TUBULIN AND VASCULAR TARGETING ACTIVITY | BAYLOR UNIVERSITY (US) | 2004-11-18 | — | — | WO | disclosed |