Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.50 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | CCR5 | P51681 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.48 |
| ▸ | ANO2 | Q9NQ90 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5839209 | 0.84 | ALDH1A1 (0.54) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL1388012 | 0.80 | ALDH1A1 (0.68) | ALDH1A1NPSR1KMT2AHTTNPC1 | |
| SCHEMBL5839822 | 0.80 | KMT2A (0.74) | ALDH1A1KMT2AMEN1POLBRAB9A | |
| SCHEMBL8808325 | 0.80 | MAPT (0.57) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL1319458 | 0.77 | CTSV (0.63) | ALDH1A1KMT2AMEN1POLBGAA | |
| SCHEMBL8980613 | 0.77 | ALDH1A1 (0.59) | ALDH1A1NPSR1KMT2AGAAHTT | |
| SCHEMBL5839687 | 0.77 | ALDH1A1 (0.50) | ALDH1A1LMNAKMT2AMEN1POLB | |
| SCHEMBL6725157 | 0.77 | F2 (0.48) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL8807842 | 0.77 | MAPT (0.71) | ALDH1A1LMNANPSR1KMT2AMEN1 | |
| SCHEMBL11388169 | 0.76 | HTT (0.61) | ALDH1A1LMNAKMT2AMEN1POLB |
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-6984645-B2 | Dual inhibitors of adipocyte fatty acid binding protein and keratinocyte fatty acid binding protein | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-01-10 | — | — | US | disclosed |