Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | PAM | P19021 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16036546 | 0.88 | ALDH1A1 (0.47) | ALDH1A1POLBTAS1R3TAS1R1PAM | |
| SCHEMBL8310917 | 0.74 | GPR139 (0.51) | ALDH1A1PAMMAPTNPSR1MTNR1A | |
| SCHEMBL8310911 | 0.74 | GPR139 (0.51) | ALDH1A1PAMMAPTNPSR1MTNR1A | |
| SCHEMBL3745449 | 0.73 | KMT2A (0.50) | ALDH1A1POLBPAMMAPT | |
| SCHEMBL1644965 | 0.72 | MAPK1 (0.59) | ALDH1A1POLBTAS1R3TAS1R1HDAC3 | |
| SCHEMBL9501554 | 0.71 | PAM (0.48) | ALDH1A1POLBPAMHDAC3HDAC4 | |
| SCHEMBL9501547 | 0.71 | PAM (0.48) | ALDH1A1POLBPAMHDAC3HDAC4 | |
| SCHEMBL82150 | 0.71 | MAPT (0.50) | ALDH1A1PAMMAPTNPSR1MTNR1A | |
| SCHEMBL82152 | 0.71 | MAPT (0.50) | ALDH1A1PAMMAPTNPSR1MTNR1A | |
| SCHEMBL8582344 | 0.70 | PAM (0.50) | ALDH1A1PAMMAPTMTNR1AMTNR1B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7655678-B2 | Pharmaceutical composition for the management of tumors | Council of Scientfic & Industrial Research (IN) | 2010-02-02 | — | — | US | disclosed |
| US-20060281793-A1 | Pharmaceutical composition for the management of tumors | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2006-12-14 | — | — | US | disclosed |