Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | TTK | P33981 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5797553 | 0.99 | AAK1 (0.35) | AAK1RAB9AACSS2NPC1KMT2A | |
| Hydrochloric Acid SCHEMBL5811037 | 0.90 | ALDH1A1 (0.33) | KMT2ADYRK1AMAPK1TDP1 | |
| SCHEMBL5810191 | 0.87 | TDP1 (0.33) | KMT2AHTTCYP19A1MAPK1TDP1 | |
| Hydrochloric Acid SCHEMBL5809596 | 0.87 | KMT2A (0.34) | AAK1RAB9ANPC1KMT2ADYRK1A | |
| Hydrochloric Acid SCHEMBL5811743 | 0.86 | TDP1 (0.32) | KMT2AHTTCYP19A1TDP1 | |
| Hydrochloric Acid SCHEMBL5807412 | 0.85 | ACSS2 (0.34) | AAK1ACSS2DYRK1ATDP1 | |
| Hydrochloric Acid SCHEMBL5807560 | 0.85 | LMNA (0.32) | RAB9AKMT2A | |
| SCHEMBL5810095 | 0.83 | MAPK1 (0.35) | AAK1HTTCYP19A1MAPK1TDP1 | |
| Hydrochloric Acid SCHEMBL5810379 | 0.83 | TDP1 (0.30) | TDP1 | |
| SCHEMBL5810118 | 0.83 | — | — |
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-2006025717-A1 | PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2006-03-09 | — | — | WO | claimed |