Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TYMS | P04818 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11832606 | 0.88 | ALDH1A1 (0.41) | ALDH1A1MAOAMAOBKDM4EKMT2A | |
| SCHEMBL11696687 | 0.74 | KDM4E (0.56) | ALDH1A1TYMSKDM4ETSHRCA1 | |
| SCHEMBL11599462 | 0.73 | ALDH1A1 (0.39) | ALDH1A1KDM4ECASP1CASP7HSD17B10 | |
| SCHEMBL24317500 | 0.70 | CDK2 (0.44) | ALDH1A1KDM4ETSHRALOX15HSD17B10 | |
| SCHEMBL11318564 | 0.70 | KMT2A (0.45) | ALDH1A1TSHRHSD17B10KMT2ATDP1 | |
| SCHEMBL7936537 | 0.70 | RAD52 (0.44) | ALDH1A1MAOATYMSKDM4ETSHR | |
| SCHEMBL11638611 | 0.70 | MAPT (0.43) | ALDH1A1MAOAMAOBTYMSKDM4E | |
| SCHEMBL10905704 | 0.69 | KMT2A (0.40) | ALDH1A1KDM4ETSHRHSD17B10KMT2A | |
| SCHEMBL27006381 | 0.69 | DRD2 (0.35) | USP2KMT2ATDP1PARP1CES1 | |
| SCHEMBL29532654 | 0.69 | DRD2 (0.35) | USP2KMT2ATDP1PARP1CES1 |
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-RE29834-E | PREPARED FROM 4-SULFONYL-1,8-NAPHTHOLACTAMS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-11-14 | — | — | US | disclosed |
| US-3959310-A | BENZINDOLE | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-25 | — | — | US | disclosed |