Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 4/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9304714 | 0.92 | HDAC4 (0.36) | CTSAHDAC4ALDH1A1CLK1MAPT | |
| SCHEMBL9304708 | 0.82 | ALDH1A1 (0.38) | HDAC4ALDH1A1CLK1MAPTLMNA | |
| SCHEMBL9305528 | 0.81 | RAB9A (0.44) | CTSAMAPTTP53HDAC6 | |
| SCHEMBL9305097 | 0.81 | MAPT (0.49) | HDAC4ALDH1A1MAPTLMNAPOLB | |
| SCHEMBL8972467 | 0.81 | MAPT (0.40) | HDAC4ALDH1A1MAPTLMNAPOLB | |
| SCHEMBL9306816 | 0.81 | PIK3CG (0.42) | HDAC4ALDH1A1MAPTLMNAPOLB | |
| SCHEMBL10888980 | 0.80 | MAPT (0.43) | HDAC4ALDH1A1MAPTLMNAPOLB | |
| SCHEMBL8972643 | 0.79 | TP53 (0.53) | ALDH1A1MAPTLMNAPOLBTP53 | |
| SCHEMBL9305822 | 0.79 | MAPT (0.48) | ALDH1A1MAPTLMNAPOLB | |
| SCHEMBL9305802 | 0.79 | HDAC4 (0.36) | HDAC4MAPTLMNAPOLBTP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |
| US-4612049-A | BENZOTHI ZOLYL THIO-, BENZIMIDAZOLYLTHIO- OR BENZOXAZOLYLTHIO-SUBSTITUTED CARBOXY ACID | CIBA-GEIGY CORPORATION (US) | 1986-09-16 | — | — | US | disclosed |