Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MLKL | Q8NB16 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9304576 | 0.90 | IDO1 (0.62) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL9304570 | 0.84 | IDO1 (0.56) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL12051733 | 0.80 | IDO1 (0.62) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL11019120 | 0.79 | IDO1 (0.61) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL6063469 | 0.78 | KMT2A (0.54) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL11021656 | 0.78 | IDO1 (0.59) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL3842687 | 0.78 | KMT2A (0.61) | IDO1ALDH1A1POLBKMT2ASMN1; SMN2 | |
| SCHEMBL10998993 | 0.78 | IDO1 (0.59) | IDO1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL36603600 | 0.78 | KMT2A (0.61) | IDO1ALDH1A1POLBKMT2ASMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL10866540 | 0.77 | KMT2A (0.53) | IDO1ALDH1A1POLBKMT2AGAA |
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 |