Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | TLR2 | O60603 | 2/20 | 0.48 |
| ▸ | TLR1 | Q15399 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 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 | |
|---|---|---|---|---|
| SCHEMBL7688500 | 0.80 | TSHR (0.38) | ALDH1A1LMNAGAARAB9AMAPT | |
| SCHEMBL31040273 | 0.76 | CA12 (0.42) | ALDH1A1LMNACYP3A4GAACYP1A2 | |
| SCHEMBL2672411 | 0.75 | ALDH1A1 (0.56) | ALDH1A1LMNANPSR1TLR2TLR1 | |
| SCHEMBL7102328 | 0.73 | CYP19A1 (0.37) | ALDH1A1LMNACYP3A4CYP1A2CYP2D6 | |
| SCHEMBL7100452 | 0.70 | KMT2A (0.44) | ALDH1A1LMNACYP3A4GAACYP2D6 | |
| SCHEMBL7100881 | 0.70 | ALDH1A1 (0.41) | ALDH1A1NPSR1GAARAB9AMAPT | |
| SCHEMBL17673651 | 0.69 | RAB9A (0.53) | ALDH1A1LMNANPSR1TLR2TLR1 | |
| SCHEMBL15378630 | 0.69 | RAB9A (0.66) | ALDH1A1LMNANPSR1TLR2TLR1 | |
| SCHEMBL3637203 | 0.69 | JAK2 (0.48) | AURKAJAK2FGFR1PRKACAKDR | |
| SCHEMBL14937980 | 0.67 | FAAH (0.61) | ALDH1A1LMNANPSR1TLR2TLR1 |
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-6407132-B1 | ANTIHISTAMINES, ANTIALLERGENS, ANTIASTHMATICS, ANTICONVULSANTS, AND ANTIDEPRESSANTS; SKIN RASH TREATMENT | JAMES BLACK FOUNDATION LIMITED (GB) | 2002-06-18 | — | — | US | disclosed |